COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION

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Total number of items: 1649271
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STK365672
Synonyms:

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N#CCCOP(=O)(OC1CC(OC1COP(=O)(OC1CC(OC1COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1)n1cnc2c1ncnc2NC(=O)c1ccccc1)Oc1ccc(cc1)Cl)n1ccc(nc1=O)NC(=O)c1ccccc1)Oc1ccc(cc1)Cl



MFCD00308177

(5(4benzamido2oxopyrimidin1yl)2(((5(6benzamidopurin9yl)2((bis(4methoxyphenyl)phenylmethoxy)methyl)oxolan3yl)oxy(4chlorophenoxy)phosphoryl)oxymethyl)oxolan3yl)(4chlorophenyl)2cyanoethylphosphate

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(CC(O4)N5C=NC6=C5N=CN=C6NC(=O)C7=CC=CC=C7)OP(=O)(OCC8C(CC(O8)N9C=CC(=NC9=O)NC(=O)C1=CC=CC=C1)OP(=O)(OCCC#N)OC1=CC=C(C=C1)Cl)OC1=CC=C(C=C1)Cl

InChI=1SC69H61Cl2N9O16P2c18652271948(202852)69(471710511184749212953(872)302249)88415856(4062(9158)8044756364(73437465(63)80)7867(82)46158491646)9698(859455332551(71)263455)90425957(9597(848938123672)9354312350(70)243254)3961(9259)79373560(7768(79)83


STK365673
Synonyms:

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N#CCCOP(=O)(OC1CC(OC1COP(=O)(OC1CC(OC1COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1)n1cnc2c1ncnc2NC(=O)c1ccccc1)Oc1ccc(cc1)Cl)n1cnc2c1nc(NC(=O)C(C)C)(nH)c2=O)Oc1ccc(cc1)Cl

MFCD00308178

(5(6benzamidopurin9yl)2((bis(4methoxyphenyl)phenylmethoxy)methyl)oxolan3yl)(3((4chlorophenoxy)(2cyanoethoxy)phosphoryl)oxy5(2(2methylpropanoylamino)6oxo3Hpurin9yl)oxolan2yl)methyl(4chlorophenyl)phosphate

CC(C)C(=O)NC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C(O3)COP(=O)(OC4CC(OC4COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)N8C=NC9=C8N=CN=C9NC(=O)C1=CC=CC=C1)OC1=CC=C(C=C1)Cl)OP(=O)(OCCC#N)OC1=CC=C(C=C1)Cl

InChI=1SC67H63Cl2N11O16P2c141(2)63(81)7766766259(65(83)7866)744080(62)573553(9597(848933113270)9350282046(68)212950)55(9257)379098(859451302247(69)233151)96523456(7939735860(71387261(58)79)7564(82)42127581342)9154(52)368867(43149610154344162448(863)2


STK040722
Synonyms: 2-amino-7,7-dimethyl-5-oxo-4-(pyridin-4-yl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

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N#CC1=C(N)OC2=C(C1c1ccncc1)C(=O)CC(C2)(C)C

2amino77dimethyl5oxo4(pyridin4yl)5678tetrahydro4Hchromene3carbonitrile

2AMINO77DIMETHYL5OXO4PYRIDIN4YL68DIHYDRO4HCHROMENE3CARBONITRILE

302777157

ZINC000002294835

ZINC000002294836

2AMINO77DIMETHYL5OXO4(4PYRIDYL)4H678TRIHYDROCHROMENE3CARBONITRILE

MFCD00475802

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=NC=C3)C(=O)C1)C

InChI=1SC17H17N3O2c117(2)712(21)1513(817)2216(19)11(918)14(15)1035206410h3614H7819H212H3


STK081469
Synonyms: (6Z)-2-ethyl-5-imino-6-{3-[2-(2-methylphenoxy)ethoxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

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CCc1sc2=NC(=O)C(=Cc3cccc(c3)OCCOc3ccccc3C)C(=N)n2n1

(6Z)2ethyl5imino6(3(2(2methylphenoxy)ethoxy)benzylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one

(Z)2ethyl5imino6(3(2(otolyloxy)ethoxy)benzylidene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one

MFCD02109894

ZINC000009066510


STK083358
Synonyms: N-[(3-chloro-4-methylphenyl)carbamothioyl]-2-(4-ethylphenoxy)acetamide

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CCc1ccc(cc1)OCC(=O)NC(=S)Nc1ccc(c(c1)Cl)C

MFCD03271019

N((3CHLORO4METHYLPHENYL)CARBAMOTHIOYL)2(4ETHYLPHENOXY)ACETAMIDE

N(3CHLORO4METHYLPHENYL)N((4ETHYLPHENOXY)ACETYL)THIOUREA

ZINC000000678960

ZINC00678960

ZINC678960

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)C)Cl

InChI=1SC18H19ClN2O2Sc13135815(9613)231117(22)2118(24)20147412(2)16(19)1014h410H311H212H3(H220212224)


STK165569
Synonyms: (5E)-3-(4-fluorobenzyl)-5-{[1-(2-methylphenyl)-1H-pyrrol-2-yl]methylidene}imidazolidine-2,4-dione

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Fc1ccc(cc1)CN1C(=O)NC(=Cc2cccn2c2ccccc2C)C1=O

(5E)3((4FLUOROPHENYL)METHYL)5((1(2METHYLPHENYL)PYRROL2YL)METHYLIDENE)IMIDAZOLIDINE24DIONE

(5E)3(4FLUOROBENZYL)5((1(2METHYLPHENYL)1HPYRROL2YL)METHYLIDENE)IMIDAZOLIDINE24DIONE

MFCD03699383

ZINC000100332181

ZINC100332181

CC1=CC=CC=C1N2C=CC=C2C=C3C(=O)N(C(=O)N3)CC4=CC=C(C=C4)F

InChI=1SC22H18FN3O2c115523720(15)25124618(25)131921(27)26(22(28)2419)141681017(23)11916h213H14H21H3(H2428)b1913+


STK336621
Synonyms: 2-[4-(propan-2-yl)phenoxy]-N-[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]acetamide

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O=C(Nc1cc(ccc1N1CCCC1)C(F)(F)F)COc1ccc(cc1)C(C)C

2(4(propan2yl)phenoxy)N(2(pyrrolidin1yl)5(trifluoromethyl)phenyl)acetamide

2(4ISOPROPYLPHENOXY)N(2PYRROLIDIN1YL5TRIFLUOROMETHYLPHENYL)ACETAMIDE

2(4PROPAN2YLPHENOXY)N(2PYRROLIDIN1YL5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE

ZINC000017087316

ZINC17087316

MFCD05852028

CC(C)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

InChI=1SC22H25F3N2O2c115(2)165818(9616)291421(28)26191317(22(2324)25)71020(19)2711341227h5101315H34111214H212H3(H2628)


STK348318
Synonyms: N-(3,4-dimethylphenyl)-1-(2,2-dimethylpropanoyl)piperidine-4-carboxamide

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O=C(C1CCN(CC1)C(=O)C(C)(C)C)Nc1ccc(c(c1)C)C

N(34dimethylphenyl)1(22dimethylpropanoyl)piperidine4carboxamide

MFCD09458262

ZINC000012864806

ZINC12864806

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C(C)(C)C)C

InChI=1SC19H28N2O2c1136716(1214(13)2)2017(22)1581021(11915)18(23)19(34)5h671215H811H215H3(H2022)


STK416686
Synonyms: N-ethyl-2,4,6-tri(propan-2-yl)benzenesulfonamide

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CCNS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C

Nethyl246tri(propan2yl)benzenesulfonamide

ZINC000005591716

ZINC05591716

ZINC5591716

ETHYL((246TRIS(METHYLETHYL)PHENYL)SULFONYL)AMINE

349116310

MFCD02859728

CCNS(=O)(=O)C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C

InChI=1SC17H29NO2Sc181821(1920)1715(12(4)5)914(11(2)3)1016(17)13(6)7h91318H8H217H3


STK614843
Synonyms: N-(naphthalen-2-yl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

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O=C(c1ccc2c(c1)(nH)c(=O)c(=O)(nH)2)Nc1ccc2c(c1)cccc2

N(naphthalen2yl)23dioxo1234tetrahydroquinoxaline6carboxamide

883467649

ZINC000006664831

ZINC06664831

ZINC6664831

MFCD07439257

Nnaphthalen2yl23dioxo14dihydroquinoxaline6carboxamide

C1=CC=C2C=C(C=CC2=C1)NC(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

InChI=1SC19H13N3O3c2317(20147511312412(11)914)13681516(1013)2219(25)18(24)2115h110H(H2023)(H2124)(H2225)


STK750661
Synonyms: 4-chloro-2-[(E)-{[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl]-3,5-dimethylphenol

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COc1ccc(cc1)c1oc2c(n1)cc(cc2)N=Cc1c(O)cc(c(c1C)Cl)C

4chloro2((E)((2(4methoxyphenyl)13benzoxazol5yl)imino)methyl)35dimethylphenol

MFCD00739049

ZINC000001445050


STK874482
Synonyms: 1-(4-cyano-2-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}-1,3-oxazol-5-yl)piperidine-4-carboxamide

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N#Cc1nc(oc1N1CCC(CC1)C(=O)N)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)C

1(4cyano2(4((4methylpiperidin1yl)sulfonyl)phenyl)13oxazol5yl)piperidine4carboxamide

1(4CYANO2(4((4METHYLPIPERIDIN1YL)SULFONYL)PHENYL)OXAZOL5YL)PIPERIDINE4CARBOXAMIDE

1(4CYANO2(4((4METHYLPIPERIDYL)SULFONYL)PHENYL)13OXAZOL5YL)PIPERIDINE4CARBOXAMIDE

ZINC000012421236

ZINC12421236

941000368

MFCD09762414

1(4cyano2(4(4methylpiperidin1yl)sulfonylphenyl)13oxazol5yl)piperidine4carboxamide

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)N4CCC(CC4)C(=O)N)C#N

InChI=1SC22H27N5O4Sc11561227(13715)32(2930)184217(3518)212519(1423)22(3121)2610816(91126)20(24)28h251516H613H21H3(H22428)


STK950748
Synonyms: 2,2'-{(1,9-dioxononane-1,9-diyl)bis[(1E)hydrazin-2-yl-1-ylidene(E)methylylidene]}dibenzoicacid

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O=C(NN=Cc1ccccc1C(=O)O)CCCCCCCC(=O)NN=Cc1ccccc1C(=O)O

22((19dioxononane19diyl)bis((1E)hydrazin2yl1ylidene(E)methylylidene))dibenzoicacid

2((1E)2(8(N((1E)2(2CARBOXYPHENYL)1AZAVINYL)CARBAMOYL)OCTANOYLAMINO)2AZAVINYL)BENZOICACID

ZINC000008871565

ZINC35329258

MFCD04583195

2((E)((9((2E)2((2carboxyphenyl)methylidene)hydrazinyl)9oxononanoyl)hydrazinylidene)methyl)benzoicacid

C1=CC=C(C(=C1)C=NNC(=O)CCCCCCCC(=O)NN=CC2=CC=CC=C2C(=O)O)C(=O)O

InChI=1SC25H28N4O6c3022(2826161810681220(18)24(32)33)14421351523(31)2927171911791321(19)25(34)35h6131617H151415H2(H2830)(H2931)(H3233)(H3435)b2616+2717+


STK262485
Synonyms:

STL106338
Synonyms: 3-(3-methoxybenzyl)-2-[(4-methylbenzyl)sulfanyl]quinazolin-4(3H)-one

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COc1cccc(c1)Cn1c(SCc2ccc(cc2)C)nc2c(c1=O)cccc2

3(3methoxybenzyl)2((4methylbenzyl)sulfanyl)quinazolin4(3H)one

MFCD20737682

ZINC000067258757

ZINC67258757

3((3methoxyphenyl)methyl)2((4methylphenyl)methylsulfanyl)quinazolin4one

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC(=CC=C4)OC

InChI=1SC24H22N2O2Sc117101218(131117)1629242522943821(22)23(27)26(24)151965720(1419)282h314H1516H212H3


STL165443
Synonyms: 1-(2,6-dimethylphenyl)-3-(3-fluoro-4-methylphenyl)thiourea

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S=C(Nc1c(C)cccc1C)Nc1ccc(c(c1)F)C

1(26DIMETHYLPHENYL)3(3FLUORO4METHYLPHENYL)THIOUREA

CC1=C(C(=CC=C1)C)NC(=S)NC2=CC(=C(C=C2)C)F

InChI=1SC16H17FN2Sc1107813(914(10)17)1816(20)191511(2)54612(15)3h49H13H3(H2181920)


STK004070
Synonyms: 5-(pyridin-4-yl)-1,3,4-oxadiazol-2(3H)-one
Smiles: O=c1[nH]nc(o1)c1ccncc1

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O=c1(nH)nc(o1)c1ccncc1

ZINC000000287719

ZINC287719

DELTA214OXADIAZOLIN5ONE2(4PYRIDYL)

134OXADIAZOL2(3H)ONE5(4PYRIDINYL)

134OXADIAZOL2(3H)ONE5(4PYRIDINYL)(9CI)

134OXADIAZOL2OL5(4PYRIDINYL)

14OXADIAZOL2(3H)ONE5(4PYRIDINYL)

2845821

2PYRIDYL(4)134OXADIAZOLON(5)

5(4PYRIDINYL)134OXADIAZOL2(3H)ONE

5(4PYRIDINYL)134OXADIAZOL2OL

5(4PYRIDYL)134OXADIAZOL2OL

5(4PYRIDYL)3H134OXADIAZOL2ONE

5(PYRIDIN4YL)134OXADIAZOL2(3H)ONE

5(PYRIDIN4YL)23DIHYDRO134OXADIAZOL2ONE

5(PYRIDIN4YL)3H(134)OXADIAZOL2ONE

5PYRIDIN4YL134OXADIAZOL2(3H)ONE

5PYRIDIN4YL134OXADIAZOL2OL

5PYRIDIN4YL3H(134)OXADIAZOL2ONE

5PYRIDIN4YL3H134OXADIAZOL2ONE

C1=CN=CC=C1C2=NNC(=O)O2

InChI=1SC7H5N3O2c1171096(127)5138425h14H(H1011)


STK028768
Synonyms: quinoline-8-carboxylicacid
Smiles: OC(=O)c1cccc2c1nccc2

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OC(=O)c1cccc2c1nccc2

QUINOLINE8CARBOXYLICACID

ZINC000000331733

ZINC331733

8CARBOXYQUINOLINE

8QUINOLINECARBOXYLICACID

C1=CC2=C(C(=C1)C(=O)O)N=CC=C2

InChI=1SC10H7NO2c1210(13)85137426119(7)8h16H(H1213)


STK031059
Synonyms: 8-(benzylamino)-7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(NCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

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Clc1ccccc1Cn1c(NCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

305863916

7((2CHLOROPHENYL)METHYL)13DIMETHYL8(BENZYLAMINO)137TRIHYDROPURINE26DIONE

8(BENZYLAMINO)7((2CHLOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE

8(BENZYLAMINO)7(2CHLOROBENZYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE

MFCD01553751

ZINC000000625428

ZINC00625428

ZINC625428

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CC=CC=C3)CC4=CC=CC=C4Cl

InChI=1SC21H20ClN5O2c1251817(19(28)26(2)21(25)29)27(131510671116(15)22)20(2418)2312148435914h311H1213H212H3(H2324)


STK183349
Synonyms: 2,6-dimethyl-1,2,3,4-tetrahydroquinolin-4-ol
Smiles: CC1CC(O)c2c(N1)ccc(c2)C

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CC1CC(O)c2c(N1)ccc(c2)C

26dimethyl1234tetrahydroquinolin4ol

InChI=1SC11H15NOc1734109(57)11(13)68(2)1210h3581113H6H212H3


STK215952
Synonyms: ethyl2-({2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C(Sc2nnc(s2)N)C)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)C(Sc2nnc(s2)N)C)sc2c1CCCC2

ethyl2((2((5amino134thiadiazol2yl)sulfanyl)propanoyl)amino)4567te

ethyl2((2((5amino134thiadiazol2yl)sulfanyl)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate

571926868

MFCD04664446

ZINC000003575721

ZINC000003575722

ethyl2(2((5amino134thiadiazol2yl)sulfanyl)propanoylamino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(C)SC3=NN=C(S3)N

InChI=1SC16H20N4O3S3c132314(22)119645710(9)2513(11)1812(21)8(2)2416201915(17)2616h8H37H212H3(H21719)(H1821)


STK295348
Synonyms: 3-bromo-N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-4-methoxybenzamide
Smiles: CCc1nnc2n1nc(s2)c1ccc(cc1)CNC(=O)c1ccc(c(c1)Br)OC

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CCc1nnc2n1nc(s2)c1ccc(cc1)CNC(=O)c1ccc(c(c1)Br)OC

3bromoN(4(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)benzyl)4methoxybenzamide

MFCD09960626

ZINC000013954832

ZINC13954832

3bromoN((4(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)methyl)4methoxybenzamide

CCC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)CNC(=O)C4=CC(=C(C=C4)OC)Br

InChI=1SC20H18BrN5O2Sc131723242026(17)2519(2920)136412(5713)112218(27)148916(282)15(21)1014h410H311H212H3(H2227)


STL151292
Synonyms: [5,10,15,20-tetraphenylporphyrinato(2-)-kappa~2~N~21~,N~23~]cobalt
Smiles: c1ccc(cc1)C1=C2C=CC(=N2)C(=c2n3[Co]n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1ccccc1)c1ccccc1)c1ccccc1

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c1ccc(cc1)C1=C2C=CC(=N2)C(=c2n3(Co)n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1ccccc1)c1ccccc1)c1ccccc1

(5101520tetraphenylporphyrinato(2)kappa~2~N~21~N~23~)cobalt

14172908

MFCD00010725

(1Z6Z12Z17Z)271217tetraphenyl21232425tetraaza22cobaltahexacyclo(9931^(36)1^(1316)0^(823)0^(1821))pentacosa13(25)46810121416(24)1719undecaene


BBL000001
Synonyms: 1,3-diphenyl-1H-pyrazole-4-carboxylicacid
Smiles: OC(=O)c1cn(nc1c1ccccc1)c1ccccc1

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OC(=O)c1cn(nc1c1ccccc1)c1ccccc1

1111111

13DIPHENYL1HPYRAZOLE4CARBOXYLICACID

13DIPHENYLPYRAZOLE4CARBOXYLICACID

1HPYRAZOLE4CARBOXYLICACID13DIPHENYL

77169121

ZINC381031

MFCD00475348

C1=CC=C(C=C1)C2=NN(C=C2C(=O)O)C3=CC=CC=C3

InChI=1SC16H12N2O2c1916(20)141118(1395261013)1715(14)127314812h111H(H1920)


BBL000002
Synonyms: 1,1'-(sulfonyldibenzene-3,1-diyl)dihydrazine
Smiles: NNc1cccc(c1)S(=O)(=O)c1cccc(c1)NN

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NNc1cccc(c1)S(=O)(=O)c1cccc(c1)NN

ZINC000002505854

ZINC02505854

ZINC2505854

(3(3HYDRAZINYLPHENYL)SULFONYLPHENYL)HYDRAZINE

11(SULFONYLDIBENZENE31DIYL)DIHYDRAZINE

443292884

MFCD03030046

C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)NN)NN

InChI=1SC12H14N4O2Sc1315931511(79)19(1718)1262410(812)1614h181516H1314H2


BBL000003
Synonyms: 4,6-dimethyl-2-(methylsulfonyl)pyrimidine
Smiles: Cc1cc(C)nc(n1)S(=O)(=O)C

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Cc1cc(C)nc(n1)S(=O)(=O)C

PYRIMIDINE46DIMETHYL2(METHYLSULFONYL)

ZINC02510664

ZINC2510664

2(METHYLSULFONYL)46DIMETHYLPYRIMIDINE

2(METHYLSULFONYL)46DIMETHYLPYRIMIDINE2METHANESULFONYL46DIMETHYLPYRIMIDINE46DIMETHYL2(METHYLSULFONYL)PYRIMIDINE

20781060

2MES46DIMETHYLPYRIMIDINE

2METHANESULFONYL46DIMETHYLPYRIMIDINE

2METHANESULFONYL46DIMETHYPYRIMIDINE

46DIMETHYL2(METHYLSULFONYL)PYRIMIDINE

46DIMETHYL2(METHYLSULPHONYL)PYRIMIDINE

46DIMETHYL2MESYLPYRIMIDINE

46DIMETHYL2METHYLSULFONYLPYRIMIDINE

CC1=CC(=NC(=N1)S(=O)(=O)C)C

InChI=1SC7H10N2O2Sc1546(2)97(85)12(310)11h4H13H3


BBL000004
Synonyms: [4-(benzyloxy)phenoxy]aceticacid
Smiles: OC(=O)COc1ccc(cc1)OCc1ccccc1

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OC(=O)COc1ccc(cc1)OCc1ccccc1

ZINC000000156216

ZINC156216

MFCD00014361

(4(BENZYLOXY)PHENOXY)ACETICACID

(4(PHENYLMETHOXY)PHENOXY)ACETICACID

(4BENZYLOXYPHENOXY)ACETICACID

2(4(BENZYLOXY)PHENOXY)ACETICACID

2(4(PHENYLMETHOXY)PHENOXY)ACETICACID

2(4PHENYLMETHOXYPHENOXY)ACETICACID

38559921

4(BENZYLOXY)PHENOXYACETICACID

4BENZYLOXYPHENOXYACETICACID

ACETICACID(4(PHENYLMETHOXY)PHENOXY)

ACETICACID2(4(PHENYLMETHOXY)PHENOXY)

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCC(=O)O

InChI=1SC15H14O4c1615(17)1119148613(7914)1810124213512h19H1011H2(H1617)


BBL000005
Synonyms: 6-bromo-1,2,4-triazine-3,5(2H,4H)-dione
Smiles: Brc1n[nH]c(=O)[nH]c1=O

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Brc1n(nH)c(=O)(nH)c1=O

ZINC18106308

124TRIAZINE35(2H4H)DIONE6BROMO

5BROMO6AZAURACIL

6BROMO(124)TRIAZINE35DIOL

6BROMO124TRIAZINE35(2H4H)DIONE

6BROMO124TRIAZINE35DIOL

6BROMO24DIHYDRO124TRIAZINE35DIONE

6BROMO2H(124)TRIAZINE35DIONE

6BROMO2H124TRIAZINE35DIONE

6BROMO2H4H124TRIAZINE35DIONE

6BROMO35DIOXO(2H4H)124TRIAZINE

6BROMOASTRIAZINE35(2H4H)DIONE

ASTRIAZINE35(2H4H)DIONE6BROMO

C1(=O)C(=NNC(=O)N1)Br

InChI=1SC3H2BrN3O2c412(8)53(9)761h(H25789)


BBL000006
Synonyms: naphthalen-2-yl2-hydroxybenzoate
Smiles: O=C(c1ccccc1O)Oc1ccc2c(c1)cccc2

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O=C(c1ccccc1O)Oc1ccc2c(c1)cccc2

SALICYLICACID2NAPHTHYLESTER

SALICYLICACID2NAPHTHYLESTER(8CI)

SALINAPHTHOL

ZINC000000121580

ZINC00121580

ZINC121580

MFCD00227474

NAPHTHALEN2YL2HYDROXYBENZOATE

NAPHTHALOL

NAPHTHOSALOL

2HYDROXYBENZOICACID2NAPHTHALENYLESTER

2NAPHTHOLSALICYLATE

2NAPHTHYL2HYDROXYBENZOATE

2NAPHTHYLSALICYLATE

613785

BENZOICACID2HYDROXY2NAPHTHALENYLESTER

BENZOICACID2HYDROXY2NAPHTHALENYLESTER(9CI)

BENZOICACID2NAPHTHALENYLESTER

BETANAPHTHOLSALICYLATE

BETANAPHTHYLSALICYLATE

C1=CC=C2C=C(C=CC2=C1)OC(=O)C3=CC=CC=C3O

InChI=1SC17H12O3c1816843715(16)17(19)201410912512613(12)1114h11118H


BBL000007
Synonyms: [ethane-1,2-diylbis(nitrilodimethanediyl)]tetrakis(phosphonicacid)
Smiles: OP(=O)(CN(CP(=O)(O)O)CCN(CP(=O)(O)O)CP(=O)(O)O)O

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OP(=O)(CN(CP(=O)(O)O)CCN(CP(=O)(O)O)CP(=O)(O)O)O

PHOSPHONICACID(12ETHANEDIYLBIS(NITRILOBIS(METHYLENE)))TETRAKIS

PHOSPHONICACID(12ETHANEDIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISHEXASODIUMSALT

PHOSPHONICACIDPPPP(12ETHANEDIYLBIS(NITRILOBIS(METHYLENE)))TETRAKIS

PHOSPHONICACIDPPPP(12ETHANEDIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISSODIUMSALT(16)

MFCD00058893

NNNNETHYLENEDIAMINETETRAKIS(METHYLENEPHOSPHONICACID)

(((2(BISPHOSPHONOMETHYLAMINO)ETHYL)PHOSPHONOMETHYLAMINO)METHYL)PHOSPHONICACID

(2(BIS(PHOSPHONOMETHYL)AMINO)ETHYL(PHOSPHONOMETHYL)AMINO)METHYLPHOSPHONICACID

TETRASODIUMTETRAHYDROGEN(ETHANE12DIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONATE

ZINC000019855121

ZINC19855121

(ETHANE12DIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONICACID

(ETHANE12DIYLBIS(NITRILODIMETHANEDIYL))TETRAKIS(PHOSPHONICACID)

(ETHYLENEBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONICACIDSODIUMSALT

(ETHYLENEDINITRILO)TETRAMETHYLENEPHOSPHONICACID

1429501

BIS(PHOSPHONOMETHYL)(2(BIS(PHOSPHONOMETHYL)AMINO)ETHYL)AMINE

ETHYLENEBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONICACIDSODIUMSALT

ETHYLENEBIS(NITRILODIMETHYLENE)TETRAPHOSPHONICACIDHEXASODIUMSALT

ETHYLENEBISTETRAPHOSPHONICACID

ETHYLENEDIAMINENNNNTETRAKIS(METHYLENEPHOSPHONICACID)

ETHYLENEDIAMINETETRA(METHYLENEPHOSPHONICACID)

ETHYLENEDIAMINETETRAKIS(METHYLENEPHOSPHONICACID)

ETHYLENEDIAMINETETRAKIS(METHYLENEPHOSPHONICACID)HEXASODIUMSALT

HEXASODIUMDIHYDROGEN(ETHANE12DIYLBIS(NITRILOBIS(METHYLENE)))TETRAKISPHOSPHONATE

C(CN(CP(=O)(O)O)CP(=O)(O)O)N(CP(=O)(O)O)CP(=O)(O)O

InChI=1SC6H20N2O12P4c921(1011)37(422(1213)14)128(523(1516)17)624(1819)20h16H2(H291011)(H2121314)(H2151617)(H2181920)


BBL000008
Synonyms: tris(4-methylphenyl)phosphate
Smiles: Cc1ccc(cc1)OP(=O)(Oc1ccc(cc1)C)Oc1ccc(cc1)C

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Cc1ccc(cc1)OP(=O)(Oc1ccc(cc1)C)Oc1ccc(cc1)C

CRESYLPHOSPHATE

4METHYLPHENYLDI4METHYLPHENYLPHOSPHATE

78320

TRICRESYLPHOSPHATE3OISOMER

TRICRESYLPHOSPHATENOT1OISOMER

TRICRESYLPHOSPHATES

TRIPCRESYLPHOSPHATE

TRIPTOLYLPHOSPHATE

TRIS(4METHYLPHENYL)PHOSPHATE

TRIS(METHYLPHENYL)ESTEROFPHOSPHORICACID

TRIS(METHYLPHENYL)PHOSPHATE

TRIS(PCRESYL)PHOSPHATE

TRIS(PMETHYLPHENYL)PHOSPHATE

TRIS(TOLYLOXY)PHOSPHINEOXIDE

TRISPTOLYLPHOSPHATE

TRITOLYLPHOSPHATE

TRITOLYLPHOSPHATE1OISOMER

TRITOLYLPHOSPHATENOT1OISOMER

TRITOLYLPHOSPHATETECHNICALGRADEMIXTUREOFISOMERS

ZINC000001577195

ZINC01577195

ZINC1577195

LINDOL

MFCD00041908

PHOSPHATEDETRICRESYLE(FRENCH)

PHOSPHORICACIDTOLYLESTER

PHOSPHORICACIDTRI(4TOLYL)ESTER

PHOSPHORICACIDTRICRESYLESTER

PHOSPHORICACIDTRIPCRESYLESTER

PHOSPHORICACIDTRIPTOLYLESTER

PHOSPHORICACIDTRIPTOLYLESTER(8CI)

PHOSPHORICACIDTRIS(4METHYLPHENYL)

PHOSPHORICACIDTRIS(4METHYLPHENYL)ESTER

PHOSPHORICACIDTRIS(METHYLPHENYL)ESTER

PHOSPHORICACIDTRITOLYLESTER

PTOLYLPHOSPHATE((C7H7O)3PO)

THIORTHOCRESYLPHOSPHATE

TOLYLPHOSPHATE

TRICRESYLORTHOPHOSPHATE

TRICRESYLPHOSPHATE(TRITOLYLPHOSPHATE)

TRICRESYLPHOSPHATE1OISOMER

CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C

InChI=1SC21H21O4Pc11641019(11516)2326(22242012617(2)71320)252114818(3)91521h415H13H3


BBL000009
Synonyms: naphthalene-1,5-diamine
Smiles: Nc1cccc2c1cccc2N

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Nc1cccc2c1cccc2N

ZINC000000154653

ZINC00154653

ZINC154653

MFCD00004029

NAPHTHALENE15DIAMINE

15DIAMINONAPHTALENE

15DIAMINONAPHTHALENE

15NAPHTHALENEDIAMINE

15NAPHTHYLENEDIAMINE

15NAPTHALENEDIAMINE

2243621

C1=CC2=C(C=CC=C2N)C(=C1)N

InChI=1SC10H10N2c11951378(9)42610(7)12h16H1112H2


BBL000010
Synonyms: 1,3,5-triazine-2,4,6-triamine
Smiles: Nc1nc(N)nc(n1)N

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Nc1nc(N)nc(n1)N

STRIAMINOTRIAZINE

STRIAZINE246TRIAMINO

STRIAZINE46DIAMINO12DIHYDRO2IMINO

STRIAZINE46TRIAMINO

STRIAZINETRIAMINE

SYMTRIAMINOTRIAZINE

TRIAMINOTRIAZINE

YUKAMELAMINE

ZINC000000897751

ZINC00897751

ZINC897751

135TRIAZINANE246TRIIMINE

135TRIAZINE246(1H3H5H)TRIIMINE

135TRIAZINE246TRIAMINE

15TRIAZINE246(1H3H5H)TRIIMINE

15TRIAZINE246TRIAMINE

246TRIAMINO135TRIAZINE

246TRIAMINO135TRIAZINEMONOMER

246TRIAMINOSTRIAZINE

246TRIAMINOSYMTRIAZINE

246TRIAMINOTRIAZINE

26TRIAMINO135TRIAZINE

26TRIAMINOSTRIAZINE

26TRIAMINOTRIAZINE

(135)TRIAZINE246TRIAMINE

108781

MELAMINEMONOMER

MFCD00006055

CYANURAMIDE

CYANURICTRIAMIDE

CYANUROTRIAMIDE

CYANUROTRIAMINE

CYANURTRIAMIDE

ISOMELAMINE

MELAMINE

MELAMINE13C3

C1(=NC(=NC(=N1)N)N)N

InChI=1SC3H6N6c4172(5)93(6)81h(H6456789)


BBL000011
Synonyms: 2-amino-2-(hydroxymethyl)propane-1,3-diol
Smiles: OCC(CO)(CO)N

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OCC(CO)(CO)N

METHANAMINE111TRIS(HYDROXYMETHYL)

METHANAMINE11TRIS(HYDROXYMETHYL)

METHYLAMINE111TRIS(HYDROXYMETHYL)

METHYLAMINE11TRIS(HYDROXYMETHYL)

MFCD00004679

111TRIS(HYDROXYMETHYL)METHANAMINE

12AMINO2(HYDROXYMETHYL)

TRI(HYDROXYMETHYL)AMINOMETHANE

TRIMETHYLOLAMINOMETHANE

TRIS(HYDROXYDMETHYL)AMINOD2METHANE98ATOMD

TRIS(HYDROXYMETHY)AMINOMETHANE

TRIS(HYDROXYMETHYL)AMINOETHANE

TRIS(HYDROXYMETHYL)AMINOMETHANE

TRIS(HYDROXYMETHYL)AMINOMETHANETHAMTRISBASETROMETAMOL

TRIS(HYDROXYMETHYL)METHANAMINE

TRIS(HYDROXYMETHYL)METHYLAMINE

TRIS(HYDROXYMETHYLY)AMINOMETHANE

TRISAMIN

TRISAMINE

TRISAMINO

TRISAMINOL

TRISBUFFERTRISHYDROXYMETHYLAMINOMETHAN

TRISHYDROXYMETHYLAMINOMETHAN

TRISHYDROXYMETHYLAMINOMETHANE

TRISULTRAPURE

TRISULTRAPUREEP

TROMETAMOL

TROMETAMOL(JANINN)

TROMETAMOLE

TROMETAMOLTROMETHAMINETRIS(HYDROXYMETHYL)AMINOMETHANE

TROMETAMOLUM

TROMETAMOLUM(INNLATIN)

TROMETHAMIN

TROMETHAMINE

TROMETHAMINE(USAN)

TROMETHAMINE(USP)

TROMETHAMOLUM

TROMETHANE

TROMETHANMIN

ZINC000000896695

ZINC896695

13PROPANEDIOL2AMINO2(HYDROXYMETHYL)

2(HYDROXYMETHYL)2AMINO13PROPANEDIOL

2AMINO2(HYDROXYMETHYL)13PROPANDIOL

2AMINO2(HYDROXYMETHYL)13PROPANEDIOL

2AMINO2(HYDROXYMETHYL)PROPANE13DIOL

2AMINO2HYDROXYMETHYL13PROPANEDIOL

2AMINO2HYDROXYMETHYL13PROPANEDIOLSOLUTION

2AMINO2HYDROXYMETHYLPROPANE13DIOL

2AMINO2HYDROXYMETHYLPROPANEDIOL

2AMINO2METHYLOL13PROPANEDIOL

2AMINO2METHYLOLPROPANE13DIOL

77861

AMINOTRI(HYDROXYMETHYL)METHANE

AMINOTRIMETHYLOLMETHANE

AMINOTRIS(HYDROXYMETHYL)METHANE

C(C(CO)(CO)N)O

InChI=1SC4H11NO3c54(1627)38h68H135H2


BBL000012
Synonyms: 4-methyl-3-nitrobenzenesulfonamide
Smiles: [O-][N+](=O)c1cc(ccc1C)S(=O)(=O)N

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(O)(N+)(=O)c1cc(ccc1C)S(=O)(=O)N

2NITROTOLUENE4SULPHONAMIDE

4(2NITRO)TOLUENESULPHONAMIDE

4METHYL3NITROBENZENE1SULFONAMIDE

4METHYL3NITROBENZENESULFONAMIDE

6949231

BENZENESULFONAMIDE4METHYL3NITRO

MFCD00460611

ZINC000003865902

ZINC03865902

ZINC3865902

CC1=C(C=C(C=C1)S(=O)(=O)N)(N+)(=O)(O)

InChI=1SC7H8N2O4Sc15236(14(812)13)47(5)9(10)11h24H1H3(H281213)


BBL000013
Synonyms: methyl3,5-dinitrobenzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

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COC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)

2702581

35DINITROBENZOICACIDMETHYLESTER

BENZOICACID35DINITROMETHYLESTER

METHYL35DINITROBENZOATE

MFCD00017016

ZINC000001683476

ZINC01683476

ZINC1683476

COC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))(N+)(=O)(O)

InChI=1SC8H6N2O6c1168(11)526(9(12)13)47(35)10(14)15h24H1H3


BBL000014
Synonyms: 2,2'-(E)-ethene-1,2-diylbis(5-aminobenzenesulfonicacid)
Smiles: Nc1ccc(c(c1)S(=O)(=O)O)/C=C/c1ccc(cc1S(=O)(=O)O)N

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Nc1ccc(c(c1)S(=O)(=O)O)C=Cc1ccc(cc1S(=O)(=O)O)N

PODISULFONICACID

PPDIAMINODIPHENYLETHYLENEOODISULFONICACID

PPDIAMINOSTILBENEOODISULFONICACID

ZINC000003844586

ZINC3844586

2((1E)2(4AMINO2SULFOPHENYL)VINYL)5AMINOBENZENESULFONICACID

22((E)12ETHENEDIYL)BIS(5AMINOBENZENESULFONICACID)

22(12ETHENEDIYL)BIS(5AMINOBENZENESULFONICACID)

22(12ETHYLENEDIYL)BIS(5AMINOBENZENESULFONICACID)

22(E)ETHENE12DIYLBIS(5AMINOBENZENESULFONICACID)

22DISULFO44STILBENEDIAMINE

22ETHENE12DIYLBIS(5AMINOBENZENESULFONICACID)

22STILBENEDISULFONICACID44DIAMINO

44DIAMINO22STILBENEDISULFONICACID

44DIAMINO22STILBENEDISULPHONICACID

44DIAMINOSTILBENE22DISULFONICACID

44DIAMINOSTILBENE22DISULPHONICACID

5AMINO2((E)2(4AMINO2SULFOPHENYL)ETHENYL)BENZENE1SULFONICACID

5AMINO2((E)2(4AMINO2SULFOPHENYL)ETHENYL)BENZENESULFONICACID

5AMINO2((E)2(4AMINO2SULFOPHENYL)VINYL)BENZENESULFONICACID

5AMINO2(2(4AMINO2SULFOPHENYL)ETHENYL)BENZENESULFONICACID

81118

BENZENE1(12ETHENEDIYL)BISDIAMINODISULFODERIV

BENZENE11(12ETHENEDIYL)BISDIAMINODISULFODERIV

BENZENESULFONICACID2(12ETHENEDIYL)BIS(5AMINO

BENZENESULFONICACID22((E)12ETHENEDIYL)BIS(5AMINO

BENZENESULFONICACID22(12ETHENEDIYL)BIS(5AMINO

BENZENESULFONICACID22(12ETHENEDIYL)BIS(5AMINO(E)

(E)44DIAMINO22STILBENDISULFONSAEURE

(E)44DIAMINOSTILBENE22DISULFONICACID

BENZENESULFONICACID22(12ETHYLENEDIYL)BIS(5AMINO

BENZENESULFONICACID22(12ETHYLENEDIYL)BIS(5AMINO(9CI)

DIAMINOSTILBENEDISULFONICACID

FLAVONICACID

MFCD00024946

C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O

InChI=1SC14H14N2O6S2c1511539(13(711)23(1718)19)12104612(16)814(10)24(2021)22h18H1516H2(H171819)(H202122)b21+


BBL000015
Synonyms: 2-{(E)-[4-(dimethylamino)phenyl]diazenyl}benzoicacid
Smiles: CN(c1ccc(cc1)/N=N/c1ccccc1C(=O)O)C

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CN(c1ccc(cc1)N=Nc1ccccc1C(=O)O)C

2((E)(4(dimethylamino)phenyl)diazenyl)benzoicacid

845103

MFCD00002425

ZINC000003877658


BBL000016
Synonyms: 1-nitrosonaphthalen-2-ol
Smiles: O=Nc1c(O)ccc2c1cccc2

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O=Nc1c(O)ccc2c1cccc2

ZINC000017821066

ZINC100480167

ZINC104083490

MFCD00003884

NITROSOBETANAPHTHOL

(1E)1(HYDROXYIMINO)NAPHTHALEN2(1H)ONE

(E)1(HYDROXYIMINO)NAPHTHALEN2(1H)ONE

ZINC17821066

12NAPHTHALENEDIONE1OXIME

12NAPHTHALENEDIONEMONOOXIME

12NAPHTHOQUINONE1OXIME

131919

1NITROSO2NAFTOL

1NITROSO2NAPHTHALENOL

1NITROSO2NAPHTHOL

1NITROSONAPHTHALEN2OL

1NITROSONAPHTHALENE2OL

2NAPHTHALENOL1NITROSO

2NAPHTHOL1NITROSO

ALPHANITROSOBETANAFTOL

ALPHANITROSOBETANAPHTHOL

ALPHANITROSOBETANAPHTHOLOXIME

ALPHANITROSONAPHTHOL

C1=CC=C2C(=C1)C=CC(=C2N=O)O

InChI=1SC10H7NO2c12965731248(7)10(9)1113h1612H


BBL000017
Synonyms: 1-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)N

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COc1ccc(cc1)NC(=O)N

(4MEHOXYPHENYL)UREA

(4METHOXYPHENYL)UREA

(PMETHOXYPHENYL)UREA

1(4METHOXYPHENYL)UREA

1566423

4METHOXYPHENYLUREA

AMINON(4METHOXYPHENYL)AMIDE

MFCD00014789

N(4METHOXYPHENYL)UREA

PANISYLUREA

PMETHOXYPHENYLUREA

UREA(4METHOXYPHENYL)

UREA(4METHOXYPHENYL)(9CI)

UREA(PMETHOXYPHENYL)

UREAN(4METHOXYPHENYL)

ZINC000000174337

ZINC00174337

ZINC174337

COC1=CC=C(C=C1)NC(=O)N

InChI=1SC8H10N2O2c1127426(357)108(9)11h25H1H3(H391011)


BBL000018
Synonyms: 3-chloro-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonicacid
Smiles: CC1=NN(C(=O)C1)c1ccc(cc1Cl)S(=O)(=O)O

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CC1=NN(C(=O)C1)c1ccc(cc1Cl)S(=O)(=O)O

MFCD00044052

ZINC000004016139

ZINC4016139

3CHLORO4(3METHYL5OXO(2PYRAZOLINYL))BENZENESULFONICACID

3CHLORO4(3METHYL5OXO45DIHYDRO1HPYRAZOL1YL)BENZENESULFONICACID

3CHLORO4(3METHYL5OXO45DIHYDROPYRAZOL1YL)BENZENESULFONICACID

3CHLORO4(3METHYL5OXO4HPYRAZOL1YL)BENZENESULFONICACID

6534334

BENZENESULFONICACID3CHLORO4(3METHYL5OXO2PYRAZOLIN1YL)

BENZENESULFONICACID3CHLORO4(45DIHYDRO3METHYL5OXO1HPYRAZOL1YL)

CC1=NN(C(=O)C1)C2=C(C=C(C=C2)S(=O)(=O)O)Cl

InChI=1SC10H9ClN2O4Sc16410(14)13(126)9327(58(9)11)18(1516)17h235H4H21H3(H151617)


BBL000019
Synonyms: 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoicacid
Smiles: OC(=O)CCN1C(=O)c2c(C1=O)cccc2

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OC(=O)CCN1C(=O)c2c(C1=O)cccc2

PHTALOYLBETAALANINE

PHTHALOYLBETAALANINE

PHTHALYLBETAALANINE

ZINC000000091964

ZINC91964

2HISOINDOLE2PROPANOICACID13DIHYDRO13DIOXO

2HISOINDOLE2PROPANOICACID13DIHYDRO13DIOXO(9CI)

2HISOINDOLE2PROPANOICACID3DIHYDRO13DIOXO

3(13DIHYDRO13DIOXO2HISOINDOL2YL)PROPANOICACID

3(13DIOXO13DIHYDRO2HISOINDOL2YL)PROPANOICACID

3(13DIOXO13DIHYDROISOINDOL2YL)PROPANOICACID

3(13DIOXO13DIHYDROISOINDOL2YL)PROPIONICACID

3(13DIOXO23DIHYDRO1HISOINDOL2YL)PROPANOICACID

3(13DIOXOBENZO(C)AZOLIN2YL)PROPANOICACID

3(13DIOXOISOINDOL2YL)PROPANOICACID

3(13DIOXOISOINDOLIN2YL)PROPANOICACID

3(PHTHALIMID1YL)PROPANOICACID

3(PHTHALIMIDO)PROPIONICACID

3339739

3PHTALIMIDOPROPANOICACID

3PHTHALIMIDOPROPANOICACID

3PHTHALIMIDOPROPIONICACID

BETAALANINEPHTHALOLYL

BETAPHTHALIMIDOPROPIONICACID

BPHTHALIMIDOPROPIONICACID

13DIHYDRO13DIOXO2HISOINDOLE2PROPANOICACID

13DIHYDRO13DIOXO2HISOINDOLE2PROPIONICACID

N(2CARBOXYETHYL)PHTHALIMIDE

NNPHTHALOYLBETAALANINE

NPHTHALOYLBETAALANINE

MFCD00023096

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)O

InChI=1SC11H9NO4c139(14)561210(15)731248(7)11(12)16h14H56H2(H1314)


BBL000020
Synonyms: 1-(prop-2-en-1-yl)-1H-tetrazol-5-amine
Smiles: C=CCn1nnnc1N

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C=CCn1nnnc1N

ZINC16954942

1(PROP2EN1YL)1HTETRAZOL5AMINE

1ALLYL1HTETRAZOL5AMINE

1PROP2ENYLTETRAZOL5AMINE

74999227

C=CCN1C(=NN=N1)N

InChI=1SC4H7N5c12394(5)6789h2H13H2(H2568)


BBL000021
Synonyms: 2-{4-[(cyclohexylamino)methyl]-2-methoxyphenoxy}acetamide
Smiles: COc1cc(CNC2CCCCC2)ccc1OCC(=O)N

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COc1cc(CNC2CCCCC2)ccc1OCC(=O)N

MFCD02916893

ZINC000000349823

ZINC349823

2(4((CYCLOHEXYLAMINO)METHYL)2METHOXYPHENOXY)ACETAMIDE

2(4CYCLOHEXYLAMINOMETHYL2METHOXYPHENOXY)ACET

2(4CYCLOHEXYLAMINOMETHYL2METHOXYPHENOXY)ACETAMIDE

425646588

COC1=C(C=CC(=C1)CNC2CCCCC2)OCC(=O)N

InChI=1SC16H24N2O3c12015912(7814(15)211116(17)19)1018135324613h791318H261011H21H3(H21719)


BBL000022
Synonyms: 1-propyl-1H-tetrazol-5-amine
Smiles: CCCn1nnnc1N

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CCCn1nnnc1N

ZINC01462461

ZINC1462461

1PROPYL1HTETRAZOL5AMINE

1PROPYL1HTETRAZOL5YLAMINE

1PROPYLTETRAZOL5AMINE

CCCN1C(=NN=N1)N

InChI=1SC4H9N5c12394(5)6789h23H21H3(H2568)


BBL000023
Synonyms: 1-butyl-1H-tetrazol-5-amine
Smiles: CCCCn1nnnc1N

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CCCCn1nnnc1N

1BUTYL1HTETRAZOL5AMINE

1BUTYL1HTETRAZOLE5AMINE

1BUTYLTETRAZOL5AMINE

1HTETRAZOL5AMINE1BUTYL

6280315

MFCD05625811

ZINC000001712713

ZINC01712713

ZINC1712713

CCCCN1C(=NN=N1)N

InChI=1SC5H11N5c1234105(6)78910h24H21H3(H2679)


BBL000024
Synonyms: 1-methyl-1H-tetrazol-5-amine
Smiles: Cn1nnnc1N

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Cn1nnnc1N

ZINC16890072

(1METHYL1HTETRAZOL5YL)AMINE

1HTETRAZOL5AMINE1METHYL

1HTETRAZOLE5AMINO1METHYL

1METHYL1HTETRAZOL5AMINE

1METHYL1HTETRAZOL5YLAMINE

1METHYL5AMINE1HTETRAZOLE

1METHYL5AMINO1HTETRAZOLE

1METHYL5AMINOTETRAZOLE

1METHYL5TETRAZOLAMINE

1METHYLTETRAZOL5AMINE

5422446

5AMINO1METHYL1HTETRAZOLE

5AMINO1METHYLTETRAZOLE

CN1C(=NN=N1)N

InChI=1SC2H5N5c172(3)4567h1H3(H2346)


BBL000025
Synonyms: 6-bromonaphthalene-1,2-dione
Smiles: Brc1ccc2c(c1)C=CC(=O)C2=O

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Brc1ccc2c(c1)C=CC(=O)C2=O

ZINC01670110

ZINC1670110

12NAPHTHALENEDIONE6BROMO

12NAPHTHALENEDIONE6BROMO(9CI)

12NAPHTHOQUINONE6BROMO

6954489

6BROM12NAPHTHOCHINON

6BROMO12DIHYDRONAPHTHALENE12DIONE

6BROMO12NAPHTHALENEDIONE

6BROMO12NAPHTHOQUINONE

6BROMONAPHTHALENE12DIONE

BONAPHTHON

BONAPHTHONE

C1=CC2=C(C=CC(=O)C2=O)C=C1Br

InChI=1SC10H5BrO2c1172386(57)149(12)10(8)13h15H


BBL000026
Synonyms: ethyl5-hydroxy-2-methyl-1-benzofuran-3-carboxylate
Smiles: Cc1oc2c(c1C(=O)OCC)cc(cc2)O

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Cc1oc2c(c1C(=O)OCC)cc(cc2)O

MFCD00023001

ZINC000000095509

ZINC00095509

ZINC95509

3BENZOFURANCARBOXYLICACID5HYDROXY2METHYLETHYLESTER

5HYDROXY2METHYL3BENZOFURANCARBOXYLICACIDETHYLESTER

5HYDROXY2METHYLBENZOFURAN3CARBOXYLICACIDETHYLESTER

7287403

ETHYL2METHYL5OXIDANYL1BENZOFURAN3CARBOXYLATE

ETHYL5HYDROXY2METHYL1BENZOFURAN3CARBOXYLATE

ETHYL5HYDROXY2METHYL3BENZOFURANCARBOXYLATE

ETHYL5HYDROXY2METHYLBENZO(B)FURAN3CARBOXYLATE

ETHYL5HYDROXY2METHYLBENZOFURAN3CARBOXYLATE

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)C

InChI=1SC12H12O4c131512(14)117(2)1610548(13)69(10)11h4613H3H212H3


BBL000027
Synonyms: diethyl3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
Smiles: CCOC(=O)c1[nH]c(c(c1C)C(=O)OCC)C

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CCOC(=O)c1(nH)c(c(c1C)C(=O)OCC)C

KNORRSPYRROLE

DIETHYL24DIMETHYL1HPYRROLE35DICARBOXYLATE

DIETHYL24DIMETHYLPYRROLE35DICARBOXYLATE

DIETHYL34DICARBOXYLATE

DIETHYL35DIMETHYL1HPYRROLE24DICARBOXYLATE

DIETHYL35DIMETHYL24PYRROLEDICARBOXYLATE

DIETHYL35DIMETHYLPYRROLE24DICARBOXYLATE

DIETHYL5METHYL3METHYL1HPYRROLE24DICARBOXYLATE

ETHYL4(ETHOXYCARBONYL)35DIMETHYLPYRROLE2CARBOXYLATE

1HPYRROLE235DIMETHYLDIETHYLESTER

1HPYRROLE24DICARBOXYLICACID35DIMETHYLDIETHYLESTER

MFCD00005218

PYRROLE235DIMETHYLDIETHYLESTER

PYRROLE24DICARBOXYLICACID35DIMETHYLDIETHYLESTER

PYRROLE35BIS(CARBOXYLICACID)24DIMETHYLDIETHYLESTER

ZINC000000097687

ZINC00097687

ZINC97687

1HPYRROLE24DIMETHYL35DIETHOXYCARBONYL

1HPYRROLE25DICARBOXYLICACID34DIMETHYL25DIETHYLESTER

2436795

24DIETHOXYCARBONYL35DIMETHYLPYRROLE

24DIETHYL35DIMETHYL1HPYRROLE24DICARBOXYLATE

24DIMETHYL35DICARBETHOXYPYRROLE

24DIMETHYL35DIETHOXYCARBONYLPYRROLE

25DICARBETHOXYPYRROLE

35DIMETHYL1HPYRROLE24DICARBOXYLICACIDDIETHYLESTER

35DIMETHYL24PYRROLEDICARBOXYLICACIDDIETHYLESTER

3POUNDNOT5DIMETHYL1HPYRROLE2POUNDNOT4DICARBOXYLICACIDDIETHYLESTER

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)C

InChI=1SC12H17NO4c151611(14)97(3)10(138(9)4)12(15)1762h13H56H214H3


BBL000028
Synonyms: 1-(5-nitrothiophen-2-yl)ethanone
Smiles: CC(=O)c1ccc(s1)[N+](=O)[O-]

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CC(=O)c1ccc(s1)(N+)(=O)(O)

ETHANONE1(5NITRO2THIENYL)

ETHANONE1(5NITRO2THIENYL)(9CI)

KETONEMETHYL(5NITRO2THIENYL)

MFCD00041211

THIOPHENE2ACETYL5NITRO

ZINC000000085317

ZINC00085317

ZINC85317

1(5NITRO2THIENYL)ETHAN1ONE

1(5NITRO2THIENYL)ETHANONE

1(5NITRO2THIOPHENYL)ETHANONE

1(5NITROTHIOPHEN2YL)ETHAN1ONE

1(5NITROTHIOPHEN2YL)ETHANONE

2ACETYL5NITROTHIOPHENE

39565009

5NITRO2ACETYLTHIOPHENE

CC(=O)C1=CC=C(S1)(N+)(=O)(O)

InChI=1SC6H5NO3Sc14(8)5236(115)7(9)10h23H1H3


BBL000029
Synonyms: 4,5-dihydro-1,3-thiazol-2-amine
Smiles: NC1=NCCS1

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NC1=NCCS1

THIAZOLIDIN(2E)YLIDENEAMINE

THIAZOLIDIN2IMINE

ZINC000018354955

ZINC18354955

1779813

2AMINO2THIAZOLINE

2AMINO45DIHYDRO13THIAZOLE

2AMINO45DIHYDROTHIAZOLE

2AMINO45DIHYDROTHIAZOLINE

2AMINODELTA(2)THIAZOLINE

2AMINODELTA2THIAZOLINE

2AMINOTHIAZOLINE

2AMINOTHIAZOLINE(VAN)

2IMINOTHIAZOLIDINE

2THIAZOLAMINE45DIHYDRO

2THIAZOLAMINE5DIHYDRO

2THIAZOLIDINIMINE

2THIAZOLIN2AMINE

2THIAZOLIN2YLAMINE

2THIAZOLINE2AMINO

45DIHYDRO13THIAZOL2AMINE

45DIHYDRO2THIAZOLAMINE

45DIHYDROTHIAZOL2AMINE

45DIHYDROTHIAZOL2YLAMINE

13THIAZOLIDIN2IMINE

13THIAZOLINE2YLAMINE

MFCD00005313

C1CSC(=N1)N

InChI=1SC3H6N2Sc4351263h12H2(H245)


BBL000030
Synonyms: 1-chloro-4-(4-methoxyphenyl)phthalazine
Smiles: COc1ccc(cc1)c1nnc(c2c1cccc2)Cl

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COc1ccc(cc1)c1nnc(c2c1cccc2)Cl

128615838

1CHLORO4(4METHOXYPHENYL)PHTHALAZINE

MFCD03030035

ZINC000002505846

ZINC02505846

ZINC2505846

COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)Cl

InChI=1SC15H11ClN2Oc119118610(7911)1412423513(12)15(16)181714h29H1H3


BBL000031
Synonyms: (2-imino-4-oxo-1,3-thiazolidin-5-yl)aceticacid
Smiles: OC(=O)CC1SC(=N)NC1=O

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OC(=O)CC1SC(=N)NC1=O

MFCD00050083

((5S)2AMINO4OXO45DIHYDRO13THIAZOL5YL)ACETICACID

(2AMINO4OXO45DIHYDRO13THIAZOL5YL)

THIAZOLACETICACID2AMINO45DIHYDRO4OXO

ZINC000004015293

ZINC000009329420

(2AMINO4OXO45DIHYDRO13THIAZOL5YL)ACETICACID

(2AMINO4OXO45DIHYDROTHIAZOL5YL)ACETICACID

(2AMINO4OXO5H13THIAZOL5YL)ACETICACID

(2IMINO4OXO13THIAZOLIDIN5YL)ACETICACID

(2IMINO4OXOTHIAZOLIDIN5YL)ACETICACID

2(2AMINO4OXO13THIAZOL5YL)ACETICACID

2(2AMINO4OXO45DIHYDRO13THIAZOL5YL)ACETICACID

2(2IMINO4OXO13THIAZOLIDIN5YL)ACETICACID

2(2IMINO4OXOTHIAZOLIDIN5YL)ACETICACID

2IMINO4OXOTHIAZOLIDINE5ACETICACID

2IMINO4OXYTHIAZOLE5ACETICACID

2THIAZOLINE5ACETICACID2AMINO4OXO

33176419

5THIAZOLEACETICACID2AMINO45DIHYDRO4OXO

5THIAZOLEACETICACID5DIHYDRO4OXO

5THIAZOLIDINEACETICACID2IMINO4OXO

ACETICACID(2IMINO4OXO5THIAZOLIDINYL)

ACETICACID(5PSEUDOTHIOHYDANTOINYL)

ACETICACID2(2AMINO4OXO2THIAZOLIN5YL)

C(C1C(=O)N=C(S1)N)C(=O)O

InChI=1SC5H6N2O3Sc6574(10)2(115)13(8)9h2H1H2(H89)(H26710)


BBL000032
Synonyms: 2-amino-7-(4-methoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one
Smiles: COc1ccc(cc1)C1CC(=O)c2c(C1)nc(nc2)N

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COc1ccc(cc1)C1CC(=O)c2c(C1)nc(nc2)N

2AMINO7(4METHOXYPHENYL)78DIHYDRO5(6H)QUINAZOLINONE

2AMINO7(4METHOXYPHENYL)78DIHYDRO6HQUINAZOLIN5ONE

2AMINO7(4METHOXYPHENYL)78DIHYDROQUINAZOLIN5(6H)ONE

354767741

COC1=CC=C(C=C1)C2CC3=NC(=NC=C3C(=O)C2)N

InChI=1SC15H15N3O2c12011429(3511)1061312(14(19)710)81715(16)1813h25810H67H21H3(H2161718)


BBL000033
Synonyms: 1-butyl-1H-benzimidazol-2-amine
Smiles: CCCCn1c(N)nc2c1cccc2

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CCCCn1c(N)nc2c1cccc2

MFCD00159973

ZINC000002475956

ZINC2475956

(1BUTYLBENZIMIDAZOL2YL)AMINEHYDROCHLORIDE

1BUTYL13BENZODIAZOL2AMINE

1BUTYL1HBENZIMIDAZOL2AMINE

1BUTYL1HBENZO(D)IMIDAZOL2AMINE

1BUTYL1HBENZOIMIDAZOL2YLAMINE

1BUTYL2BENZIMIDAZOLAMINEHYDROCHLORIDE

1BUTYLBENZIMIDAZOL2AMINE

1BUTYLBENZIMIDAZOL2AMINEHYDROCHLORIDE

1BUTYLBENZIMIDAZOLE2YLAMINE

1HBENZIMIDAZOL2AMINENBUTYL

2AMINO1(NBUTYL)BENZIMIDAZOLE

91337450

CCCCN1C2=CC=CC=C2N=C1N

InChI=1SC11H15N3c1238141075469(10)1311(14)12h47H238H21H3(H21213)


BBL000034
Synonyms: 4,5-dibromofuran-2-carbaldehyde
Smiles: O=Cc1oc(c(c1)Br)Br

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O=Cc1oc(c(c1)Br)Br

ZINC00802085

ZINC802085

2433854

2FURANCARBOXALDEHYDE45DIBROMO

45BIS(BROMANYL)FURAN2CARBALDEHYDE

45DIBROMO2FURALDEHYDE

45DIBROMO2FURANCARBALDEHYDE

45DIBROMO2FURANCARBOXALDEHYDE

45DIBROMOFURAN2CARBALDEHYDE

45DIBROMOFURAN2CARBOXALDEHYDE

C1=C(OC(=C1Br)Br)C=O

InChI=1SC5H2Br2O2c6413(28)95(4)7h12H


BBL000035
Synonyms: 3'-aminobiphenyl-4-carboxylicacid
Smiles: Nc1cccc(c1)c1ccc(cc1)C(=O)O

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Nc1cccc(c1)c1ccc(cc1)C(=O)O

ZINC000002574116

ZINC2574116

MFCD03424680

(11BIPHENYL)4CARBOXYLICACID3AMINO

124221698

3AMINO(11BIPHENYL)4CARBOXYLICACID

3AMINO11BIPHENYL4CARBOXYLICACID

3AMINOBIPHENYL4CARBOXYLICACID

4(3AMINOPHENYL)BENZOICACID

4BIPHENYL3AMINOCARBOXYLICACID

C1=CC(=CC(=C1)N)C2=CC=C(C=C2)C(=O)O

InChI=1SC13H11NO2c141231211(812)94610(759)13(15)16h18H14H2(H1516)


BBL000036
Synonyms: ethyl4-[(phenylcarbonyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1ccccc1

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CCOC(=O)c1ccc(cc1)NC(=O)c1ccccc1

ETHYL4((PHENYLCARBONYL)AMINO)BENZOATE

ETHYL4(BENZOYLAMINO)BENZOATE

ETHYL4(NBENZOYL)AMINOBENZOATE

ETHYL4(PHENYLCARBONYLAMINO)BENZOATE

ETHYL4BENZAMIDOBENZOATE

ETHYLPBENZAMIDOBENZOATE

4(BENZOYLAMINO)BENZOICACIDETHYLESTER

4BENZOYLAMINOBENZOICACIDETHYLESTER

4CARBETHOXYBENZANILIDE

736403

BENZOICACID4(BENZOYLAMINO)ETHYLESTER

BENZOICACIDPBENZAMIDOETHYLESTER

MFCD00026828

ZINC000000102710

ZINC00102710

ZINC102710

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2

InChI=1SC16H15NO3c122016(19)1381014(11913)1715(18)126435712h311H2H21H3(H1718)


BBL000037
Synonyms: diphenylphosphinodithioicacid
Smiles: SP(=S)(c1ccccc1)c1ccccc1

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SP(=S)(c1ccccc1)c1ccccc1

ZINC1498196

MFCD00014457

PHOSPHINODITHIOICACIDDIPHENYL

DIPHENYL(SULFANYL)EPHOSPHANETHIONE

DIPHENYL(SULFANYL)L(5)PHOSPHANETHIONE

DIPHENYL(SULFANYL)PHOSPHANETHIONE

DIPHENYLDITHIOPHOSPHINICACID

DIPHENYLPHOSPHINODITHIOICACID

DIPHENYLSULFANYLSULFANYLIDENE

1015389

DIPHENYLSULFANYLSULFANYLIDENEPHOSPHORANE

DITHIODIPHENYLPHOSPHINICACID

diphenylsulfanylsulfanylidene$l^(5)phosphane

C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)S

InChI=1SC12H11PS2c1413(15117314811)1295261012h110H(H1415)


BBL000038
Synonyms: (4,5-dihydro-1H-imidazol-2-ylsulfanyl)aceticacid
Smiles: OC(=O)CSC1=NCCN1

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OC(=O)CSC1=NCCN1

ZINC000019593711

ZINC19593711

ACETICACID(45DIHYDRO1HIMIDAZOL2YLTHIO)

(45DIHYDRO1HIMIDAZOL2YLSULFANYL)ACETICAC

(45DIHYDRO1HIMIDAZOL2YLSULFANYL)ACETICACID

(45DIHYDRO1HIMIDAZOL2YLTHIO)ACETICACID

19951236

2(2IMIDAZOLIN2YLTHIO)ACETICACID

2(45DIHYDRO1HIMIDAZOL2YLSULFANYL)ACETICACID

MFCD00457419

2(45dihydro1Himidazol3ium2ylsulfanyl)acetate

C1C(NH+)=C(N1)SCC(=O)(O)

InChI=1SC5H8N2O2Sc84(9)310561275h13H2(H67)(H89)


BBL000039
Synonyms: (2-propyl-1H-benzimidazol-1-yl)aceticacid
Smiles: CCCc1nc2c(n1CC(=O)O)cccc2

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CCCc1nc2c(n1CC(=O)O)cccc2

MFCD01022054

ZINC000000194316

ZINC194316

(2PROPYL13BENZODIAZOL1YL)ACETICACID

(2PROPYL1HBENZIMIDAZOL1YL)ACETICACID

(2PROPYLBENZOIMIDAZOL1YL)ACETICACID

2(2PROPYL1H13BENZODIAZOL1YL)ACETICACID

2(2PROPYLBENZIMIDAZOL1YL)ACETICACID

2(2PROPYLBENZIMIDAZOLYL)ACETICACID

331736926

ACETICACID2(2PROPYL1BENZIMIDAZOLYL)

CCCC1=NC2=CC=CC=C2N1CC(=O)O

InChI=1SC12H14N2O2c12511139634710(9)14(11)812(15)16h3467H258H21H3(H1516)


BBL000040
Synonyms: ethyl2-[(chloroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCl)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)CCl)sc2c1CCCC2

ethyl2((chloroacetyl)amino)4567tetrahydro1benzothiophene3carboxylate

ETHYLCHLOROACETYLAMINOTETRAHYDROBENZOTHIOPHENECARBOXYLATE

60442413

MFCD00030282

ZINC000000059004

ZINC00059004

ZINC59004

ethyl2((2chloroacetyl)amino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCl

InChI=1SC13H16ClNO3Sc121813(17)11853469(8)1912(11)1510(16)714h27H21H3(H1516)


BBL000041
Synonyms: 3,5-dichloro-2-methoxybenzaldehyde
Smiles: O=Cc1cc(Cl)cc(c1OC)Cl

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O=Cc1cc(Cl)cc(c1OC)Cl

ZINC01512522

ZINC1512522

2METHOXY35DICHLOROBENZALDEHYDE

35DICHLORO2METHOXYBENZALDEHYDE

76008043

COC1=C(C=C(C=C1C=O)Cl)Cl

InChI=1SC8H6Cl2O2c11285(411)26(9)37(8)10h24H1H3


BBL000042
Synonyms: 3-chloro-2-(4-methylpiperazin-1-yl)aniline
Smiles: CN1CCN(CC1)c1c(N)cccc1Cl

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CN1CCN(CC1)c1c(N)cccc1Cl

ZINC4536027

189761975

3CHLORO2(4METHYL1PIPERAZINYL)ANILINE

3CHLORO2(4METHYLPIPERAZIN1YL)ANILINE

3CHLORO2(4METHYLPIPERAZIN1YL)BENZENAMINE

3CHLORO2(4METHYLPIPERAZIN1YL)PHENYLAMINE

3CHLORO2(4METHYLPIPERAZINYL)PHENYLAMINE

CN1CCN(CC1)C2=C(C=CC=C2Cl)N

InChI=1SC11H16ClN3c1145715(8614)119(12)32410(11)13h24H5813H21H3


BBL000043
Synonyms: 2-amino-4-methoxyphenol
Smiles: COc1ccc(c(c1)N)O

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COc1ccc(c(c1)N)O

MFCD06616911

PHENOL2AMINO4METHOXY

ZINC000001304689

ZINC01304689

ZINC1304689

20734763

2AMINO4(METHYLOXY)PHENOL

2AMINO4METHOXYPHENOL

2AMINO4METHOXYPHENOLHYDROCHLORIDE

2AZANYL4METHOXYPHENOL

2AZANYL4METHOXYPHENOLHYDROCHLORIDE

2HYDROXY5METHOXYANILIN

2HYDROXY5METHOXYANILINE

3AMINO4HYDROXYANISOLE

4METHOXY2AMINOPHENOL

COC1=CC(=C(C=C1)O)N

InChI=1SC7H9NO2c1105237(9)6(8)45h249H8H21H3


BBL000044
Synonyms: 1-[4-(4-aminophenyl)piperazin-1-yl]-2,2,2-trifluoroethanone
Smiles: O=C(C(F)(F)F)N1CCN(CC1)c1ccc(cc1)N

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O=C(C(F)(F)F)N1CCN(CC1)c1ccc(cc1)N

PIPERAZINE1(4AMINOPHENYL)4(TRIFLUOROACETYL)

ZINC12856263

(4(4(TRIFLUOROACETYL)PIPERAZIN1YL)PHENYL)AMINE

1(4(4AMINOPHENYL)PIPERAZIN1YL)222TRIFLUOROETHANONE

193903354

4(1NTRIFLUOROACETYL4PIPERAZINYL)ANILINE

4(4(TRIFLUOROACETYL)1PIPERAZINYL)ANILINE

4(4(TRIFLUOROACETYL)1PIPERAZINYL)PHENYLAMINE

C1CN(CCN1C2=CC=C(C=C2)N)C(=O)C(F)(F)F

InChI=1SC12H14F3N3Oc1312(1415)11(19)187517(6818)10319(16)2410h14H5816H2


BBL000045
Synonyms: 4-phenyl-1,3-benzothiazol-2-amine
Smiles: Nc1sc2c(n1)c(ccc2)c1ccccc1

more...



Nc1sc2c(n1)c(ccc2)c1ccccc1

ZINC000020432685

ZINC20432685

MFCD11189734

21418326

4PHENYL13BENZOTHIAZOL2AMINE

4PHENYL13BENZOTHIAZOL2YLAMINE

4PHENYLBENZO(D)THIAZOL2AMINE

4PHENYLBENZOTHIAZOL2AMINE

4PHENYLBENZOTHIAZOL2YLAMINE

4PHENYLBENZOTHIAZOLE2YLAMINE

C1=CC=C(C=C1)C2=C3C(=CC=C2)SC(=N3)N

InChI=1SC13H10N2Sc1413151210(74811(12)1613)9521369h18H(H21415)


BBL000046
Synonyms: 2-(4-methylphenyl)-2H-benzotriazol-5-amine
Smiles: Cc1ccc(cc1)n1nc2c(n1)ccc(c2)N

more...



Cc1ccc(cc1)n1nc2c(n1)ccc(c2)N

MFCD00477196

ZINC000000123063

ZINC00123063

ZINC123063

(2(PTOLYL)BENZOTRIAZOL5YL)AMINE

2(4METHYLPHENYL)123BENZOTRIAZOL5AMINE

2(4METHYLPHENYL)2H123BENZOTRIAZOL5AMINE

2(4METHYLPHENYL)2HBENZOTRIAZOL5AMINE

2(4METHYLPHENYL)2HYDROBENZOTRIAZOLE5YLAMINE

2(4METHYLPHENYL)5BENZOTRIAZOLAMINE

2(4METHYLPHENYL)BENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4METHYLPHENYL)

2PTOLYL2HBENZOTRIAZOL5YLAMINE

5AMINO2(PTOLYL)2HBENZOTRIAZOLE

6659912

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)N

InChI=1SC13H12N4c192511(639)1715127410(14)813(12)1617h28H14H21H3


BBL000047
Synonyms: 2-(4-ethoxyphenyl)-2H-benzotriazol-5-amine
Smiles: CCOc1ccc(cc1)n1nc2c(n1)ccc(c2)N

more...



CCOc1ccc(cc1)n1nc2c(n1)ccc(c2)N

MFCD01063709

ZINC000000123082

ZINC00123082

ZINC123082

(2PPHENETYLBENZOTRIAZOL5YL)AMINE

2(4ETHOXYPHENYL)2H123BENZOTRIAZOL5AMINE

2(4ETHOXYPHENYL)2HBENZO(D)(123)TRIAZOL5AMINE

2(4ETHOXYPHENYL)2HBENZOTRIAZOL5AMINE

2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YLAMINE

2(4ETHOXYPHENYL)2HYDROBENZOTRIAZOLE5YLAMINE

2(4ETHOXYPHENYL)5BENZOTRIAZOLAMINE

2(4ETHOXYPHENYL)BENZOTRIAZOL5AMINE

293737903

2HBENZOTRIAZOL5AMINE2(4ETHOXYPHENYL)

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)N

InChI=1SC14H14N4Oc1219126411(5712)1816138310(15)914(13)1718h39H215H21H3


BBL000048
Synonyms: 2-(4-ethylphenyl)-2H-benzotriazol-5-amine
Smiles: CCc1ccc(cc1)n1nc2c(n1)ccc(c2)N

more...



CCc1ccc(cc1)n1nc2c(n1)ccc(c2)N

MFCD02628446

ZINC000000178824

ZINC00178824

ZINC178824

2(4ETHYLPHENYL)2H123BENZOTRIAZOL5AMINE

2(4ETHYLPHENYL)2HBENZO(D)(123)TRIAZOL5AMINE

2(4ETHYLPHENYL)2HBENZOTRIAZOL5AMINE

2(4ETHYLPHENYL)2HBENZOTRIAZOL5YLAMINE

2(4ETHYLPHENYL)BENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4ETHYLPHENYL)

429643685

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)N

InChI=1SC14H14N4c12103612(7410)1816138511(15)914(13)1718h39H215H21H3


BBL000049
Synonyms: 6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-amine
Smiles: Cc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

more...



Cc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

MFCD02258026

ZINC000000156786

ZINC00156786

ZINC156786

(6METHYL2(PTOLYL)BENZOTRIAZOL5YL)AMINE

378215793

6METHYL2(4METHYLPHENYL)2H123BENZOTRIAZOL5AMINE

6METHYL2(4METHYLPHENYL)2HBENZOTRIAZOL5AMINE

6METHYL2(4METHYLPHENYL)2HYDROBENZOTRIAZOLE5YLAMINE

6METHYL2(4METHYLPHENYL)5BENZOTRIAZOLAMINE

6METHYL2(4METHYLPHENYL)BENZOTRIAZOL5AMINE

6METHYL2PTOLYL2HBENZOTRIAZOL5YLAMINE

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C

InChI=1SC14H14N4c193511(649)181613710(2)12(15)814(13)1718h38H15H212H3


BBL000050
Synonyms: 2-(4-chlorophenyl)-6-methyl-2H-benzotriazol-5-amine
Smiles: Clc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

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Clc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

MFCD02258027

ZINC000000510203

ZINC00510203

ZINC510203

2(4CHLOROPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4CHLOROPHENYL)6METHYL2HBENZO(D)(123)TRIAZOL5AMINE

2(4CHLOROPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4CHLOROPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2(4CHLOROPHENYL)6METHYLBENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4CHLOROPHENYL)6METHYL

53105581

CC1=CC2=NN(N=C2C=C1N)C3=CC=C(C=C3)Cl

InChI=1SC13H11ClN4c1861213(711(8)15)1718(1612)10429(14)3510h27H15H21H3


BBL000051
Synonyms: 2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-amine
Smiles: CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)N

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CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)N

2(4BUTYLPHENYL)6CHLORO2H123BENZOTRIAZOL5AMINE

2(4BUTYLPHENYL)6CHLORO2HBENZOTRIAZOL5AMINE

2(4BUTYLPHENYL)6CHLORO2HBENZOTRIAZOL5YLAMINE

2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4BUTYLPHENYL)6CHLORO

443291347

MFCD03031891

ZINC000005671702

ZINC05671702

ZINC5671702

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)N

InChI=1SC16H17ClN4c1234115712(8611)211915913(17)14(18)1016(15)2021h510H2418H21H3


BBL000052
Synonyms: 2-[4-(diethylamino)-2-methylphenyl]-6-methyl-2H-benzotriazol-5-amine
Smiles: CCN(c1ccc(c(c1)C)n1nc2c(n1)cc(c(c2)N)C)CC

more...



CCN(c1ccc(c(c1)C)n1nc2c(n1)cc(c(c2)N)C)CC

2(4(DIETHYLAMINO)2METHYLPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4(DIETHYLAMINO)2METHYLPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4(DIETHYLAMINO)2METHYLPHENYL)6METHYLBENZOTRIAZOL5AMINE

2(4DIETHYLAMINO2METHYLPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2HBENZOTRIAZOL5AMINE2(4(DIETHYLAMINO)2METHYLPHENYL)6METHYL

708287347

MFCD05796782

ZINC000000558600

ZINC00558600

ZINC558600

CCN(CC)C1=CC(=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C)C

InChI=1SC18H23N5c1522(62)147818(13(4)914)2320161012(3)15(19)1117(16)2123h711H5619H214H3


BBL000053
Synonyms: 1-(1,3-benzodioxol-5-yl)-N-(4-fluorobenzyl)methanamine
Smiles: Fc1ccc(cc1)CNCc1ccc2c(c1)OCO2

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Fc1ccc(cc1)CNCc1ccc2c(c1)OCO2

MFCD01135961

N(13BENZODIOXOL5YLMETHYL)1(4FLUOROPHENYL)METHANAMINE

ZINC000004110846

ZINC4110846

(13BENZODIOXOL5YLMETHYL)(4FLUOROBENZYL)AMINE

(2H13BENZODIOXOL5YLMETHYL)((4FLUOROPHENYL)METHYL)AMINE

(2HBENZO(34D)13DIOXOLAN5YLMETHYL)((4FLUOROPHENYL)METHYL)AMINE

1(13BENZODIOXOL5YL)N(4FLUOROBENZYL)METHANAMINE

1(BENZO(D)(13)DIOXOL5YL)N(4FLUOROBENZYL)METHANAMINE

13BENZODIOXOL5YLN(4FLUOROBENZYL)METHANAMINE

346725540

BENZO(13)DIOXOL5YLMETHYL(4FLUOROBENZYL)AMINE

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=C(C=C3)F

InChI=1SC15H14FNO2c16134111(2513)817912361415(712)19101814h1717H810H2


BBL000054
Synonyms: N-(pyridin-4-ylmethyl)butan-2-amine
Smiles: CCC(NCc1ccncc1)C

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CCC(NCc1ccncc1)C

869941695

MFCD04488522

N(4PYRIDINYLMETHYL)2BUTANAMINE

N(4PYRIDINYLMETHYL)2BUTANAMINE95

N(PYRIDIN4YLMETHYL)BUTAN2AMINE

ZINC000005823178

ZINC000005823236

CCC(C)NCC1=CC=NC=C1

InChI=1SC10H16N2c139(2)1281046117510h47912H38H212H3


BBL000055
Synonyms: 2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine
Smiles: CC(NCc1cccnc1)(C)C

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CC(NCc1cccnc1)(C)C

2METHYLN(3PYRIDINYLMETHYL)2PROPANAMINE

2METHYLN(3PYRIDINYLMETHYL)2PROPANAMINE95

2METHYLN(PYRIDIN3YLMETHYL)PROPAN2AMINE

97266256

N((3PYRIDYL)METHYL)(11DIMETHYLETHYL)AMINE

N((3PYRIDYL)METHYL)TERTBUTYLAMINE

N(TERTBUTYL)N(PYRIDIN3YLMETHYL)AMINE

TERTBUTYL(PYRIDIN3YLMETHYL)AMINE

ZINC5817175

CC(C)(C)NCC1=CN=CC=C1

InChI=1SC10H16N2c110(23)12895461179h4712H8H213H3


BBL000056
Synonyms: 1-ethyl-1H-tetrazol-5-amine
Smiles: CCn1nnnc1N

more...



CCn1nnnc1N

ZINC17024933

1ETHYL1HTETRAAZOL5YLAMINE

1ETHYL1HTETRAZOL5AMINE

1ETHYL1HTETRAZOL5AMINE95

1ETHYL5AMINOTETRAZOLE

1ETHYLTETRAZOL5AMINE

1HTETRAZOL5AMINE1ETHYL

65258539

CCN1C(=NN=N1)N

InChI=1SC3H7N5c1283(4)5678h2H21H3(H2457)


BBL000057
Synonyms: 2-[(furan-2-ylmethyl)amino]ethanol
Smiles: OCCNCc1ccco1

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OCCNCc1ccco1

ZINC000007519326

ZINC7519326

MFCD07410475

2((2FURYLMETHYL)AMINO)ETHAN1OL

2((2FURYLMETHYL)AMINO)ETHANOL

2((FURAN2YLMETHYL)AMINO)ETHANOL

2(FURAN2YLMETHYLAMINO)ETHANOL

4439229

C1=COC(=C1)CNCCO

InChI=1SC7H11NO2c943867215107h12589H346H2


BBL000058
Synonyms: N-(furan-2-ylmethyl)-2-methylpropan-1-amine
Smiles: CC(CNCc1ccco1)C

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CC(CNCc1ccco1)C

(2FURYLMETHYL)ISOBUTYLAMINE

58924666

MFCD07410483

N(FURAN2YLMETHYL)2METHYLPROPAN1AMINE

ZINC000006883668

ZINC6883668

CC(C)CNCC1=CC=CO1

InChI=1SC9H15NOc18(2)61079435119h35810H67H212H3


BBL000059
Synonyms: 5-(4-bromo-2-fluorophenyl)furan-2-carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(cc1F)Br

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O=Cc1ccc(o1)c1ccc(cc1F)Br

ZINC000002506919

ZINC02506919

ZINC2506919

444284837

5(4BROMO2FLUOROPHENYL)2FURALDEHYDE

5(4BROMO2FLUOROPHENYL)FURAN2CARBALDEHYDE

MFCD03199045

C1=CC(=C(C=C1Br)F)C2=CC=C(O2)C=O

InChI=1SC11H6BrFO2c127139(10(13)57)11428(614)1511h16H


BBL000060
Synonyms: N-(4-amino-2-chlorophenyl)butanamide
Smiles: CCCC(=O)Nc1ccc(cc1Cl)N

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CCCC(=O)Nc1ccc(cc1Cl)N

723327057

MFCD03906869

N(4AMINO2CHLOROPHENYL)BUTANAMIDE

N(4AMINO2CHLOROPHENYL)BUTYRAMIDE

ZINC000000569985

ZINC00569985

ZINC569985

CCCC(=O)NC1=C(C=C(C=C1)N)Cl

InChI=1SC10H13ClN2Oc12310(14)139547(12)68(9)11h46H2312H21H3(H1314)


BBL000061
Synonyms: 2,3,4,7,8,9,10,11-octahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(1H)-imine
Smiles: N=c1c2c(sc3c2CCCC3)nc2n1CCCCC2

more...



N=c1c2c(sc3c2CCCC3)nc2n1CCCCC2

2347891011octahydro(1)benzothieno(2345)pyrimido(12a)azepin13(1H)imine

327169448


BBL000062
Synonyms: 2,6-dibromo-4-chloroaniline
Smiles: Clc1cc(Br)c(c(c1)Br)N

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Clc1cc(Br)c(c(c1)Br)N

26BIS(BROMANYL)4CHLORANYLANILINE

26DIBROMO4CHLOROANILINE

26DIBROMO4CHLOROPHENYLAMINE

4CHLORO26DIBROMOANILINE

874179

BENZENAMINE26DIBROMO4CHLORO

MFCD00051750

ZINC000000157261

ZINC00157261

ZINC157261

C1=C(C=C(C(=C1Br)N)Br)Cl

InChI=1SC6H4Br2ClNc7413(9)25(8)6(4)10h12H10H2


BBL000063
Synonyms: benzenesulfonohydrazide
Smiles: NNS(=O)(=O)c1ccccc1

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NNS(=O)(=O)c1ccccc1

PHENYLSULFOHYDRAZIDE

PHENYLSULFONYLHYDRAZIDE

PHENYLSULFONYLHYDRAZINE

POLYSTYRENESULFONYLHYDRAZIDERESIN

POROFOR

POROFORBSH

CELOGENBSH

GENITRONBSH

HYDRAZIDEBSG

HYDRAZINOPHENYLSULFONE

MFCD00007583

NITROPOREOBSH

80171

POROFORBSHPULVER

POROFORCHKHZ9

SODIUMMERCAPTODODECABORATEBSH10BENRICHED

SULFONYLHYDRAZINEPOLYMERBOUND

ZINC000000154607

ZINC00154607

ZINC154607

BENZENE1SULPHONOHYDRAZIDE

BENZENESULFOHYDRAZIDE

BENZENESULFONICACIDHYDRAZIDE

BENZENESULFONICHYDRAZIDE

BENZENESULFONOHYDRAZIDE

BENZENESULFONYLHYDRAZIDE

BENZENESULFONYLHYDRAZINE

BENZENESULPHONOHYDRAZIDE

BENZENSULFONYLHYDRAZINE

C1=CC=C(C=C1)S(=O)(=O)NN

InChI=1SC6H8N2O2Sc7811(910)6421356h158H7H2


BBL000064
Synonyms: 2-acetylhydrazinecarbothioamide
Smiles: CC(=O)NNC(=S)N

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CC(=O)NNC(=S)N

MFCD00004932

N((AMINOTHIOXOMETHYL)AMINO)ACETAMIDE

N(CARBAMOTHIOYLAMINO)ACETAMIDE

N(IMINOMERCAPTOMETHYL)ACETOHYDRAZIDE

ZINC000006602474

ZINC06602474

ZINC6602474

1(ACETYL)THIOSEMICARBAZIDE

1ACETAMIDOTHIOUREA

1ACETYL3THIOSEMICARBAZIDE

1ACETYLTHIOSEMICARBAZIDE

2302887

2ACETYLHYDRAZINECARBOTHIOAMIDE

ACETAMIDOTHIOUREA

ACETICACID2(AMINOTHIOXOMETHYL)HYDRAZIDE

ACETYLTHIOSEMICARBAZIDE

InChI=1SC3H7N3OSc12(7)563(4)8h1H3(H57)(H3468)


BBL000065
Synonyms: 10-methoxy-10-oxodecanoicacid
Smiles: COC(=O)CCCCCCCCC(=O)O

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COC(=O)CCCCCCCCC(=O)O

DECANDIOICACIDMONOMETHYLESTER

DECANEDIOICACID1METHYL

DECANEDIOICACIDMONOMETHYLESTER

DECANOICACIDMONOMETHYLESTER

METHYLHYDROGENSEBACATE

MFCD00004439

MONOMETHYLSEBACATE

SEBACICACIDMONOMETHYLESTER

ZINC000001845667

ZINC1845667

10METHOXY10OXODECANOICACID

818882

9(METHOXYCARBONYL)NONANOICACID

InChI=1SC11H20O4c11511(14)9753246810(12)13h29H21H3(H1213)


BBL000066
Synonyms: 4-nitroso-N-phenylaniline
Smiles: O=Nc1ccc(cc1)Nc1ccccc1

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O=Nc1ccc(cc1)Nc1ccccc1

PARANITROSODIPHENYLAMINE

PARANITROSONPHENYLANILINE

PHENYL4NITROSOPHENYLAMINE

PNITROSODIFENYLAMIN

PNITROSODIPHENYLAMINE

PNITROSONPHENYLANILINE

PPHENYLAMINONITROSOBENZENE

(4NITROSOPHENYL)PHENYLAMINE

156105

ZINC000003861649

ZINC03861649

ZINC3861649

ZINC6096802

4NITROSODIPHENYLAMINE

4NITROSONPHENYLANILINE

4NITROSONPHENYLBENZENAMINE

55DIBROMOBARBUTYRICACID

AMINEDIPHENYL4NITROSO

BENZENAMINE4NITROSONPHENYL

MFCD00002062

N(4NITROSOPHENYL)NPHENYLAMINE

NITROUSDIPHENYLAMIDE

NPHENYL4NITROSOANILINE

NPHENYLPARANITROSOANILINE

NPHENYLPNITROSOANILINE

DIPHENYLAMINE4NITROSO

C1=CC=C(C=C1)NC2=CC=C(C=C2)N=O

InChI=1SC12H10N2Oc1514128611(7912)13104213510h1913H


BBL000067
Synonyms: 5-chloro-2-hydroxy-3-nitrobenzaldehyde
Smiles: O=Cc1cc(Cl)cc(c1O)[N+](=O)[O-]

more...



O=Cc1cc(Cl)cc(c1O)(N+)(=O)(O)

ZINC000012504564

ZINC12504564

MFCD00462959

16634905

5CHLORO2HYDROXY3NITROBENZALDEHYDE

5CHLORO3NITROSALICYLALDEHYDE

BENZALDEHYDE5CHLORO2HYDROXY3NITRO

C1=C(C=C(C(=C1(N+)(=O)(O))O)C=O)Cl

InChI=1SC7H4ClNO4c8514(310)7(11)6(25)9(12)13h1311H


BBL000068
Synonyms: ethyl2-amino-4-(4-nitrophenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)scc1c1ccc(cc1)[N+](=O)[O-]

more...



CCOC(=O)c1c(N)scc1c1ccc(cc1)(N+)(=O)(O)

ETHYL2AMINO4(4NITROPHENYL)THIOPHENE3CARBOXYLATE

2AMINO4(4NITROPHENYL)THIOPHENE3CARBOXYLICACIDETHYLESTER

312727665

MFCD00298930

ZINC000000083551

ZINC00083551

ZINC83551

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)(N+)(=O)(O))N

InChI=1SC13H12N2O4Sc121913(16)1110(72012(11)14)8359(648)15(17)18h37H214H21H3


BBL000069
Synonyms: (1H-benzimidazol-2-ylsulfanyl)aceticacid
Smiles: OC(=O)CSc1nc2c([nH]1)cccc2

more...



OC(=O)CSc1nc2c((nH)1)cccc2

ZINC000000060423

ZINC60423

MFCD00022673

((1HBENZIMIDAZOL2YL)THIO)ACETICACID

(1H13BENZODIAZOL2YLSULFANYL)ACETICACID

(1HBENZIMIDAZOL2YL)SULPHANYL)ACETICACID

(1HBENZIMIDAZOL2YLSULFANYL)ACETICACID

(1HBENZIMIDAZOL2YLTHIO)ACETICACID

(1HBENZIMIDAZOL3IUM2YLSULFANYL)ACETATE

(1HBENZOIMIDAZOL2YLSULFANYL)ACETICACID

(1HBENZOIMIDAZOLE2YLTHIO)ACETICACID

(2BENZIMIDAZOLYLTHIO)ACETICACID

(2BENZIMIDAZOLYTHIO)ACETICACID

2((1HBENZO(D)IMIDAZOL2YL)THIO)ACETICACID

2(1H13BENZODIAZOL2YLSULFANYL)ACETICACID

2(1HBENZIMIDAZOL2YLSULFANYL)ACETICACID

2(1HBENZIMIDAZOL3IUM2YLSULFANYL)ACETATE

2(1HBENZO(D)IMIDAZOL2YLTHIO)ACETICACID

2(BENZIMIDAZOLYLTHIO)ACETICACID

2BENZIMIDAZOL2YLTHIOACETICACID

3042000

ACETICACID2(1HBENZIMIDAZOL2YLTHIO)

C1=CC=C2C(=C1)NC(=(NH+)2)SCC(=O)(O)

InChI=1SC9H8N2O2Sc128(13)514910631247(6)119h14H5H2(H1011)(H1213)


BBL000070
Synonyms: 1-(2-chloro-4-nitrophenyl)piperazine
Smiles: Clc1cc(ccc1N1CCNCC1)[N+](=O)[O-]

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Clc1cc(ccc1N1CCNCC1)(N+)(=O)(O)

PIPERAZINE1(2CHLORO4NITROPHENYL)

ZINC4131901

(2CHLORO4NITROPHENYL)PIPERAZINE

1(2CHLORO4NITROPHENYL)PIPERAZINE

114878603

C1CN(CCN1)C2=C(C=C(C=C2)(N+)(=O)(O))Cl

InChI=1SC10H12ClN3O2c11978(14(15)16)1210(9)1353124613h12712H36H2


BBL000071
Synonyms: (2E)-3-[5-(3-chloro-4-fluorophenyl)furan-2-yl]prop-2-enoicacid
Smiles: OC(=O)/C=C/c1ccc(o1)c1ccc(c(c1)Cl)F

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OC(=O)C=Cc1ccc(o1)c1ccc(c(c1)Cl)F

ZINC000008728948

ZINC8728948

MFCD05843260

(2E)3(5(3CHLORO4FLUOROPHENYL)(2FURYL))PROP2ENOICACID

(2E)3(5(3CHLORO4FLUOROPHENYL)FURAN2YL)PROP2ENOICACID

(E)3(5(3CHLORO4FLUOROPHENYL)FURAN2YL)ACRYLICACID

(E)3(5(3CHLORO4FLUOROPHENYL)FURAN2YL)PROP2ENOICACID

3(5(3CHLORO4FLUOROPHENYL)2FURYL)ACRYLICACID

847482091

C1=CC(=C(C=C1C2=CC=C(O2)C=CC(=O)O)Cl)F

InChI=1SC13H8ClFO3c141078(1411(10)15)12529(1812)3613(16)17h17H(H1617)b63+


BBL000072
Synonyms: methyl3-hydroxynaphthalene-2-carboxylate
Smiles: COC(=O)c1cc2ccccc2cc1O

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COC(=O)c1cc2ccccc2cc1O

2HYDROXY3NAPHTHALENECARBOXYLICACIDMETHYLESTER

2HYDROXY3NAPHTHOICACIDMETHYLESTER

2NAPHTHALENECARBOXYLICACID3HYDROXYMETHYLESTER

2NAPHTHOICACID3HYDROXYMETHYLESTER

2NAPHTHOICACID3HYDROXYMETHYLESTER(8CI)

3HYDROXY2NAPHTHOICACIDMETHYLESTER

883998

BETAHYDROXYNAPHTHOICACIDMETHYLESTER

METHYL2HYDROXY3NAPHTHOATE

METHYL3HYDROXY2NAPHTHALENECARBOXYLATE

METHYL3HYDROXY2NAPHTHOATE

METHYL3HYDROXYNAPHTHALENE2CARBOXYLATE

METHYLBETAHYDROXYNAPHTHOATE

MFCD00004099

ZINC000000388414

ZINC00388414

ZINC388414

COC(=O)C1=CC2=CC=CC=C2C=C1O

InChI=1SC12H10O3c11512(14)106842359(8)711(10)13h2713H1H3


BBL000073
Synonyms: 4-(1H-indol-3-yl)butanoicacid
Smiles: OC(=O)CCCc1c[nH]c2c1cccc2

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OC(=O)CCCc1c(nH)c2c1cccc2

ZINC000000057378

ZINC57378

1HINDOLE3BUTANOATE

1HINDOLE3BUTANOICACID

1HINDOLE3BUTANOICACID(9CI)

1HINDOLE3BUTYRATE

1HINDOLE3BUTYRICACID

3INDOLEBUTYRATE

3INDOLEBUTYRICACID

3INDOLEBUTYRICACID(IBA)

3INDOLEBUTYRICACIDIBA

3INDOLEBUTYRICACIDSUPPLIEDBYSELLECKCHEMICALS

3INDOLYLBUTYRICACID

3INDOLYLGAMMABUTYRICACID

3IODOLEBUTYRATE

4(1HINDOL3YL)BUTANOICACID

4(1HINDOL3YL)BUTYRATE

4(31HINDOLYL)BUTYRATE

4(31HINDOLYL)BUTYRICACID

4(3INDOLE)BUTYRATE

4(3INDOLE)BUTYRICACID

4(3INDOLYL)BUTANOICACID

4(3INDOLYL)BUTYRATE

4(3INDOLYL)BUTYRICACID

4(INDOL3YL)BUTYRATE

4(INDOLYL)BUTYRATE

(3(3INDOLYL)PROPYL)CARBOXYLICACID

14450590

4(INDOLYL)BUTYRICACID

4INDOL3YLBUTANOICACID

4INDOL3YLBUTYRATE

4INDOL3YLBUTYRICACID

4INDOL3YLBUTYRICACID(BSIISO)

BETAINDOLEBUTYRATE

BETAINDOLEBUTYRICACID

BETAINDOLYLBUTYRICACID

BINDOLEBUTYRATE

BINDOLEBUTYRICACID

BUTYRICACID4(INDOLYL)

INDOL34YLBUTYRICACID

INDOL3YLBUTYRICACID

INDOLBUTYRICACID

INDOLE3BUTANOATE

INDOLE3BUTANOICACID

INDOLE3BUTRYLATE

INDOLE3BUTRYLICACID

INDOLE3BUTYRATE

INDOLE3BUTYRICACID

INDOLE3BUTYRICACID(8CI)

INDOLEBUTYRATE

INDOLEBUTYRICACID

INDOLYL3BUTYRATE

INDOLYL3BUTYRICACID

MFCD00005664

GAMMA(3INDOLYL)BUTYRICACID

GAMMA(INDOLE3)BUTYRICACID

GAMMAINDOLE3BUTYRICACID

GAMMAINDOLEBUTYRICACID

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O

InChI=1SC12H13NO2c1412(15)734981311621510(9)11h1256813H347H2(H1415)


BBL000074
Synonyms: N-(3-aminophenyl)benzamide
Smiles: Nc1cccc(c1)NC(=O)c1ccccc1

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Nc1cccc(c1)NC(=O)c1ccccc1

ZINC000000123066

ZINC00123066

ZINC123066

16091262

3AMINOBENZANILIDE

BENZAMIDEN(3AMINOPHENYL)

MAMINOBENZANILINE

MBENZOYLAMINOANILINE

MFCD00071750

N(3AMINOPHENYL)BENZAMIDE

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N

InChI=1SC13H12N2Oc141174812(911)1513(16)105213610h19H14H2(H1516)


BBL000075
Synonyms: N-(4-amino-2-methoxyphenyl)furan-2-carboxamide
Smiles: COc1cc(N)ccc1NC(=O)c1ccco1

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COc1cc(N)ccc1NC(=O)c1ccco1

FURAN2CARBOXYLICACID(4AMINO2METHOXYPHENYL)AMIDE

110506359

2FURANCARBOXAMIDEN(4AMINO2METHOXYPHENYL)

MFCD02258028

N(4AMINO2METHOXYPHENYL)2FURAMIDE

N(4AMINO2METHOXYPHENYL)2FURYLCARBOXAMIDE

N(4AMINO2METHOXYPHENYL)FURAN2CARBOXAMIDE

ZINC000000157387

ZINC00157387

ZINC157387

COC1=C(C=CC(=C1)N)NC(=O)C2=CC=CO2

InChI=1SC12H12N2O3c1161178(13)459(11)1412(15)103261710h27H13H21H3(H1415)


BBL000076
Synonyms: N-(4-aminophenyl)butanamide
Smiles: CCCC(=O)Nc1ccc(cc1)N

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CCCC(=O)Nc1ccc(cc1)N

116884027

BUTANAMIDEN(4AMINOPHENYL)

MFCD02063077

N(4AMINOPHENYL)BUTANAMIDE

N(4AMINOPHENYL)BUTYRAMIDE

ZINC000000123129

ZINC00123129

ZINC123129

CCCC(=O)NC1=CC=C(C=C1)N

InChI=1SC10H14N2Oc12310(13)129648(11)579h47H2311H21H3(H1213)


BBL000077
Synonyms: 4,5-diphenyl-1H-imidazole
Smiles: c1ccc(cc1)c1[nH]cnc1c1ccccc1

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c1ccc(cc1)c1(nH)cnc1c1ccccc1

DIPHENYLIMIDAZOLE

DIPHENYLIMIDAZOLE(JAN)

IMIDAZOLE45DIPHENYL

IMIDAZOLE45DIPHENYL(8CI)

IMIDAZOLE5DIPHENYL

ZINC00065175

ZINC65175

1HIMIDAZOLE45DIPHENYL

1HIMIDAZOLE45DIPHENYL(9CI)

1HIMIDAZOLE5DIPHENYL

45DI(PHENYL)1HIMIDAZOLE

45DIPHENYL1HIMIDAZOL

45DIPHENYL1HIMIDAZOLE

45DIPHENYL1HIMIDAZOLE9CINME

45DIPHENYLGLYOXALINE

45DIPHENYLIMIDAZOLE

668940

C1=CC=C(C=C1)C2=C(N=CN2)C3=CC=CC=C3

InChI=1SC15H12N2c13712(841)1415(17111614)1395261013h111H(H1617)


BBL000078
Synonyms: N-(4-amino-2-methylphenyl)furan-2-carboxamide
Smiles: Nc1ccc(c(c1)C)NC(=O)c1ccco1

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Nc1ccc(c(c1)C)NC(=O)c1ccco1

ZINC000000156747

ZINC00156747

ZINC156747

2FURANCARBOXAMIDEN(4AMINO2METHYLPHENYL)

404832640

FURAN2CARBOXYLICACID(4AMINO2METHYLPHENYL)AMIDE

MFCD02018047

N(4AMINO2METHYLPHENYL)2FURAMIDE

N(4AMINO2METHYLPHENYL)2FURYLCARBOXAMIDE

N(4AMINO2METHYLPHENYL)FURAN2CARBOXAMIDE

CC1=C(C=CC(=C1)N)NC(=O)C2=CC=CO2

InChI=1SC12H12N2O2c1879(13)4510(8)1412(15)113261611h27H13H21H3(H1415)


BBL000079
Synonyms: N-(3-aminophenyl)thiophene-2-carboxamide
Smiles: Nc1cccc(c1)NC(=O)c1cccs1

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Nc1cccc(c1)NC(=O)c1cccs1

THIOPHENE2CARBOXYLICACID(3AMINOPHENYL)AMIDE

ZINC000000038192

ZINC00038192

ZINC38192

2THIOPHENECARBOXAMIDEN(3AMINOPHENYL)

39880858

MFCD02258056

N(3AMINOPHENYL)2THIENYLCARBOXAMIDE

N(3AMINOPHENYL)2THIOPHENECARBOXAMIDE

N(3AMINOPHENYL)THIOPHENE2CARBOXAMIDE

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)N

InChI=1SC11H10N2OSc1283149(78)1311(14)105261510h17H12H2(H1314)


BBL000080
Synonyms: N-(4-aminophenyl)-2-methylpropanamide
Smiles: CC(C(=O)Nc1ccc(cc1)N)C

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CC(C(=O)Nc1ccc(cc1)N)C

441053254

MFCD02258053

N(4AMINOPHENYL)2METHYLPROPANAMIDE

N(4AMINOPHENYL)ISOBUTYRAMIDE

PROPANAMIDEN(4AMINOPHENYL)2METHYL

ZINC000000157653

ZINC00157653

ZINC157653

CC(C)C(=O)NC1=CC=C(C=C1)N

InChI=1SC10H14N2Oc17(2)10(13)129538(11)469h37H11H212H3(H1213)


BBL000081
Synonyms: 1-(4-iodophenyl)ethanone
Smiles: CC(=O)c1ccc(cc1)I

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CC(=O)c1ccc(cc1)I

ETHANONE1(4IODOPHENYL)

PIODOACETOPHENONE

ZINC00160546

ZINC160546

1(4IODOPHENYL)1OXOETHANE

1(4IODOPHENYL)ETHAN1ONE

1(4IODOPHENYL)ETHANONE

13329403

1ACETYL4IODOBENZENE

4IODOACETOPHE

4IODOACETOPHENONE

4IODOPHENYLMETHYLKETONE

CC(=O)C1=CC=C(C=C1)I

InChI=1SC8H7IOc16(10)7248(9)537h25H1H3


BBL000082
Synonyms: N-(3-aminophenyl)furan-2-carboxamide
Smiles: Nc1cccc(c1)NC(=O)c1ccco1

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Nc1cccc(c1)NC(=O)c1ccco1

ZINC000000123098

ZINC00123098

ZINC123098

247109359

2FURANCARBOXAMIDEN(3AMINOPHENYL)

FURAN2CARBOXYLICACID(3AMINOPHENYL)AMIDE

MFCD00654512

N(3AMINOPHENYL)2FURAMIDE

N(3AMINOPHENYL)2FURANCARBOXAMIDE

N(3AMINOPHENYL)2FURYLCARBOXAMIDE

N(3AMINOPHENYL)FURAN2CARBOXAMIDE

C1=CC(=CC(=C1)NC(=O)C2=CC=CO2)N

InChI=1SC11H10N2O2c1283149(78)1311(14)105261510h17H12H2(H1314)


BBL000083
Synonyms: N-(4-amino-2-methylphenyl)-1-benzofuran-2-carboxamide
Smiles: Nc1ccc(c(c1)C)NC(=O)c1cc2c(o1)cccc2

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Nc1ccc(c(c1)C)NC(=O)c1cc2c(o1)cccc2

ZINC000000339200

ZINC00339200

ZINC339200

2BENZOFURANCARBOXAMIDEN(4AMINO2METHYLPHENYL)

433252245

BENZOFURAN2CARBOXYLICACID(4AMINO2METHYLPHENYL)AMIDE

BENZOFURAN2CARBOXYLICACID(4AMINO2METHYLPHENYL)AMINE

BENZOFURAN2CARBOXYLICAXID(4AMINO2METHYLPHENYL)AMINE

MFCD03030599

N(4AMINO2METHYLPHENYL)1BENZOFURAN2CARBOXAMIDE

N(4AMINO2METHYLPHENYL)BENZO(D)FURAN2YLCARBOXAMIDE

CC1=C(C=CC(=C1)N)NC(=O)C2=CC3=CC=CC=C3O2

InChI=1SC16H14N2O2c110812(17)6713(10)1816(19)15911423514(11)2015h29H17H21H3(H1819)


BBL000084
Synonyms: N-(4-amino-2-methoxyphenyl)-2-methylpropanamide
Smiles: COc1cc(N)ccc1NC(=O)C(C)C

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COc1cc(N)ccc1NC(=O)C(C)C

532417075

MFCD03453721

N(4AMINO2METHOXYPHENYL)2METHYLPROPANAMIDE

N(4AMINO2METHOXYPHENYL)ISOBUTYRAMIDE

PROPANAMIDEN(4AMINO2METHOXYPHENYL)2METHYL

ZINC000000468534

ZINC00468534

ZINC468534

CC(C)C(=O)NC1=C(C=C(C=C1)N)OC

InChI=1SC11H16N2O2c17(2)11(14)139548(12)610(9)153h47H12H213H3(H1314)


BBL000085
Synonyms: 4-[4-(2-fluorobenzyl)piperazin-1-yl]aniline
Smiles: Nc1ccc(cc1)N1CCN(CC1)Cc1ccccc1F

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Nc1ccc(cc1)N1CCN(CC1)Cc1ccccc1F

ZINC4244028

4(4((2FLUOROPHENYL)METHYL)PIPERAZIN1YL)ANILINE

4(4((2FLUOROPHENYL)METHYL)PIPERAZINYL)PHENYLAMINE

4(4(2FLUOROBENZYL)PIPERAZIN1YL)ANILINE

4(4(2FLUOROBENZYL)PIPERAZIN1YL)PHENYLAMINE

709001172

BENZENAMINE4(4((2FLUOROPHENYL)METHYL)1PIPERAZINYL)

C1CN(CCN1CC2=CC=CC=C2F)C3=CC=C(C=C3)N

InChI=1SC17H20FN3c1817421314(17)132091121(121020)167515(19)6816h18H91319H2


BBL000086
Synonyms: 1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]butan-1-one
Smiles: CCCC(=O)N1CCN(CC1)c1ccc(cc1Cl)N

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CCCC(=O)N1CCN(CC1)c1ccc(cc1Cl)N

PIPERAZINE1(4AMINO2CHLOROPHENYL)4(1OXOBUTYL)

ZINC00471815

ZINC471815

(4(4BUTYRYLPIPERAZIN1YL)3CHLOROPHENYL)AMINE

1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)BUTAN1ONE

1(4(4AMINO2CHLOROPHENYL)PIPERAZINYL)BUTAN1ONE

694446350

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N)Cl

InChI=1SC14H20ClN3Oc12314(19)188617(7918)135411(16)1012(13)15h4510H236916H21H3


BBL000087
Synonyms: 5-amino-1H-isoindole-1,3(2H)-dione
Smiles: Nc1ccc2c(c1)C(=O)NC2=O

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Nc1ccc2c(c1)C(=O)NC2=O

PHTHALIMIDE4AMINO

ZINC000000052615

ZINC00052615

ZINC52615

ISOINDOLE13(2H)DIONE5AMINO

MFCD00041854

1HISOINDOLE13(2H)DIONE5AMINO

1HISOINDOLE15AMINO

3676855

4AMINOPHTHALIMIDE

5AMINO1HISOINDOLE13(2H)DIONE

5AMINO23DIHYDRO1HISOINDOLE13DIONE

5AMINO2HBENZO(C)AZOLIDINE13DIONE

5AMINO2HISOINDOLE13DIONE

5AMINOISOINDOLE13DIONE

5AMINOISOINDOLINE13DIONE

5AMINOPHTHALIMIDE

C1=CC2=C(C=C1N)C(=O)NC2=O

InChI=1SC8H6N2O2c941256(34)8(12)107(5)11h13H9H2(H101112)


BBL000088
Synonyms: methyl3-amino-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Smiles: COC(=O)c1ccc(c(c1)N)N1CCN(CC1)C(=O)c1ccccc1

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COC(=O)c1ccc(c(c1)N)N1CCN(CC1)C(=O)c1ccccc1

3AMINO4(4BENZOYLPIPERAZIN1YL)BENZOICACIDMETHYLESTER

889946605

BENZOICACID3AMINO4(4BENZOYL1PIPERAZINYL)METHYLESTER

METHYL3AMINO4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE

METHYL3AMINO4(4BENZOYL1PIPERAZINYL)BENZOATE

METHYL3AMINO4(4BENZOYLPIPERAZIN1YL)BENZOATE

MFCD07174811

ZINC000006703757

ZINC06703757

ZINC6703757

COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)N

InChI=1SC19H21N3O3c12519(24)157817(16(20)1315)2191122(121021)18(23)145324614h2813H91220H21H3


BBL000089
Synonyms: 1-[(furan-2-ylmethyl)amino]propan-2-ol
Smiles: CC(CNCc1ccco1)O

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CC(CNCc1ccco1)O

MFCD07410478

ZINC000007519367

ZINC000007519385

1((FURAN2YLMETHYL)AMINO)PROPAN2OL

1(FURAN2YLMETHYLAMINO)PROPAN2OL

98426336

CC(CNCC1=CC=CO1)O

InChI=1SC8H13NO2c17(10)5968324118h247910H56H21H3


BBL000090
Synonyms: N-(3-aminophenyl)propanamide
Smiles: CCC(=O)Nc1cccc(c1)N

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CCC(=O)Nc1cccc(c1)N

22987106

3AMINOPROPIONYLANILIDE

3PROPIONYLAMINOANILINE

MAMINOPROPIONANILIDE

METAAMINOPROPIONANILIDE

MFCD00044021

MPROPIONYLAMINOANILINE

N(3AMINOPHENYL)PROPANAMIDE

N(3AMINOPHENYL)PROPIONAMIDE

PROPANAMIDEN(3AMINOPHENYL)

ZINC000000404200

ZINC00404200

ZINC404200

CCC(=O)NC1=CC=CC(=C1)N

InChI=1SC9H12N2Oc129(12)1185347(10)68h36H210H21H3(H1112)


BBL000091
Synonyms: N-(4-aminophenyl)-2,4-dichlorobenzamide
Smiles: Nc1ccc(cc1)NC(=O)c1ccc(cc1Cl)Cl

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Nc1ccc(cc1)NC(=O)c1ccc(cc1Cl)Cl

ZINC000000123097

ZINC00123097

ZINC123097

293737947

BENZAMIDEN(4AMINOPHENYL)24DICHLORO

MFCD00851342

N(4AMINOPHENYL)(24DICHLOROPHENYL)CARBOXAMIDE

N(4AMINOPHENYL)24DICHLOROBENZAMIDE

C1=CC(=CC=C1N)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI=1SC13H10Cl2N2Oc1481611(12(15)78)13(18)1710429(16)3510h17H16H2(H1718)


BBL000092
Synonyms: ethyl2-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3c([nH]2)cccc3)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)CSc2nc3c((nH)2)cccc3)sc2c1CCCC2

ethyl2(((1Hbenzimidazol2ylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD00296184

ZINC000000853568

ZINC00853568

ZINC853568

326018808

ethyl2((2(1Hbenzimidazol2ylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC4=CC=CC=C4N3

InChI=1SC20H21N3O3S2c122619(25)17127361015(12)2818(17)2316(24)1127202113845914(13)2220h4589H23671011H21H3(H2122)(H2324)


BBL000093
Synonyms: {4-[(2,4-dichlorobenzyl)oxy]-3-methoxyphenyl}methanol
Smiles: COc1cc(CO)ccc1OCc1ccc(cc1Cl)Cl

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COc1cc(CO)ccc1OCc1ccc(cc1Cl)Cl

(4((24DICHLOROBENZYL)OXY)3METHOXYPHENYL)METHANOL

(4((24DICHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHANOL

(4(24DICHLOROBENZYLOXY)3METHOXYPHENYL)METHANOL

872196899

MFCD05039674

ZINC000008471693

ZINC08471693

ZINC8471693

COC1=C(C=CC(=C1)CO)OCC2=C(C=C(C=C2)Cl)Cl

InChI=1SC15H14Cl2O3c11915610(818)2514(15)209113412(16)713(11)17h2718H89H21H3


BBL000094
Synonyms: 2-(acetylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylicacid
Smiles: CC(=O)Nc1sc2c(c1C(=O)O)CCCC2

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CC(=O)Nc1sc2c(c1C(=O)O)CCCC2

2(acetylamino)4567tetrahydro1benzothiophene3carboxylicacid

MFCD00228323

ZINC000000121527

ZINC121527

13130433

2acetamido4567tetrahydro1benzothiophene3carboxylicacid

CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)O

InChI=1SC11H13NO3Sc16(13)12109(11(14)15)742358(7)1610h25H21H3(H1213)(H1415)


BBL000095
Synonyms: 1-[4-(2-amino-4-chlorophenyl)piperazin-1-yl]-3-methylbutan-1-one
Smiles: CC(CC(=O)N1CCN(CC1)c1ccc(cc1N)Cl)C

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CC(CC(=O)N1CCN(CC1)c1ccc(cc1N)Cl)C

PIPERAZINE1(2AMINO4CHLOROPHENYL)4(3METHYL1OXOBUTYL)

ZINC04733386

ZINC4733386

(5CHLORO2(4(3METHYLBUTANOYL)PIPERAZIN1YL)PHENYL)AMINE

1(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)3METHYLBUTAN1ONE

5CHLORO2(4(3METHYLBUTANOYL)1PIPERAZINYL)PHENYLAMINE

879590359

CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)N

InChI=1SC15H22ClN3Oc111(2)915(20)197518(6819)144312(16)1013(14)17h341011H5917H212H3


BBL000096
Synonyms: [4-(2-amino-4-chlorophenyl)piperazin-1-yl](2-fluorophenyl)methanone
Smiles: Clc1ccc(c(c1)N)N1CCN(CC1)C(=O)c1ccccc1F

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Clc1ccc(c(c1)N)N1CCN(CC1)C(=O)c1ccccc1F

(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)(2FLUOROPHENYL)METHANONE

(5CHLORO2(4(2FLUOROBENZOYL)PIPERAZIN1YL)PHENYL)AMINE

5CHLORO2(4(2FLUOROBENZOYL)1PIPERAZINYL)PHENYLAMINE

879590188

MFCD07613586

PIPERAZINE1(2AMINO4CHLOROPHENYL)4(2FLUOROBENZOYL)

ZINC000004733361

ZINC04733361

ZINC4733361

C1CN(CCN1C2=C(C=C(C=C2)Cl)N)C(=O)C3=CC=CC=C3F

InChI=1SC17H17ClFN3Oc18125616(15(20)1112)217922(10821)17(23)13312414(13)19h1611H71020H2


BBL000097
Synonyms: 1-[4-(2-amino-6-chlorophenyl)piperazin-1-yl]propan-1-one
Smiles: CCC(=O)N1CCN(CC1)c1c(N)cccc1Cl

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CCC(=O)N1CCN(CC1)c1c(N)cccc1Cl

ZINC08703372

ZINC8703372

(3CHLORO2(4PROPIONYLPIPERAZIN1YL)PHENYL)AMINE

1(4(2AMINO6CHLOROPHENYL)PIPERAZIN1YL)PROPAN1ONE

1PROPANONE1(4(2AMINO6CHLOROPHENYL)1PIPERAZINYL)

905809805

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)N

InChI=1SC13H18ClN3Oc1212(18)166817(9716)1310(14)43511(13)15h35H26915H21H3


BBL000098
Synonyms: 1,1'-sulfonylbis(4-chlorobenzene)
Smiles: Clc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Cl

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Clc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Cl

DIPCHLOROPHENYLSULFONE

MFCD00000619

PCHLOROPHENYLSULFONE

PPDICHLORODIPHENYLSULFONE

11SULFONYLBIS(4CHLOROBENZENE)

1CHLORO4((4CHLOROPHENYL)SULFONYL)BENZENE

SULFONEBIS(PCHLOROPHENYL)

ZINC000000388307

ZINC00388307

ZINC388307

1CHLORO4(4CHLOROBENZENESULFONYL)BENZENE

1CHLORO4(4CHLOROPHENYL)SULFONYLBENZENE

44(DICHLORODIPHENYLSULPHONE)

44DICHLORODIPHENYLSULFONE

44DICHLORODIPHENYLSULPHONE

44DICHLOROPHENYLSULFONE

4CHLORO1((4CHLOROPHENYL)SULFONYL)BENZENE

4CHLORO1(4CHLOROPHENYLSULFONYL)BENZENE

4CHLOROPHENYLSULFONE

80079

BENZENE11SULFONYLBIS(4CHLORO

BENZENE1SULFONYLBIS(4CHLORO

BIS(4CHLOROPHENYL)SULFONE

BIS(4CHLOROPHENYL)SULPHONE

BIS(4CHLOROPHENYL)SULPHONE11SULPHONYLBIS(4CHLOROBENZENE)

BIS(PCHLOROPHENYL)SULFONE

C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)Cl

InChI=1SC12H8Cl2O2Sc1391511(629)17(1516)127310(14)4812h18H


BBL000099
Synonyms: ethyl3-methyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)C(=O)CCC2

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CCOC(=O)c1oc2c(c1C)C(=O)CCC2

ethyl3methyl4oxo4567tetrahydro1benzofuran2carboxylate

ETHYL3METHYL4OXO567TRIHYDROBENZO(21D)FURAN2CARBOXYLATE

ETHYL3METHYL4OXO67DIHYDRO5H1BENZOFURAN2CARBOXYLATE

MFCD01044397

ZINC000000206958

ZINC00206958

ZINC206958

108993846

CCOC(=O)C1=C(C2=C(O1)CCCC2=O)C

InChI=1SC12H14O4c131512(14)117(2)108(13)5469(10)1611h36H212H3


BBL000100
Synonyms: ethyl2-(formylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: O=CNc1sc2c(c1C(=O)OCC)CCCC2

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O=CNc1sc2c(c1C(=O)OCC)CCCC2

ethyl2(formylamino)4567tetrahydro1benzothiophene3carboxylate

62821696

ZINC000000333879

ZINC00333879

ZINC333879

MFCD00450850

ethyl2formamido4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC=O

InChI=1SC12H15NO3Sc121612(15)10853469(8)1711(10)13714h7H26H21H3(H1314)


BBL000101
Synonyms: ethyl4-chloro-5-formyl-3-methyl-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)c(Cl)c(cc2)C=O

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CCOC(=O)c1oc2c(c1C)c(Cl)c(cc2)C=O

ETHYL4CHLORO5FORMYL3METHYL1BENZOFURAN2CARBOXYLATE

137987770

4CHLORO5FORMYL3METHYLBENZOFURAN2CARBOXYLICACIDETHYLESTER

MFCD00436531

ZINC000000188460

ZINC00188460

ZINC188460

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C=O)C

InChI=1SC13H11ClO4c131713(16)127(2)109(1812)548(615)11(10)14h46H3H212H3


BBL000102
Synonyms: 2-methyl-4H-3,1-benzoxazin-4-one
Smiles: Cc1nc2ccccc2c(=O)o1

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Cc1nc2ccccc2c(=O)o1

ZINC00114133

ZINC114133

2METHYL(31)BENZOXAZIN4ONE

2METHYL31BENZOXAZA4ONE

2METHYL31BENZOXAZIN4ONE

2METHYL4H31BENZOXAZIN4ONE

2METHYL4H31BENZOXAZINE4ONE

2METHYL4HBENZO(D)(13)OXAZIN4ONE

2METHYL4HBENZO(D)(13)OXAZINE4ONE

2METHYL4OXO31BENZOXAZINE

2METHYL4OXO4H31BENZOXAZINE

2METHYLBENZO(D)(13)OXAZIN4ONE

2METHYLBENZO(D)13OXAZIN4ONE

4H31BENZOXAZIN4ONE2METHYL

4H32METHYL

525768

ACETANTHRANIL

ACETYLANTHRANIL

CC1=NC2=CC=CC=C2C(=O)O1

InChI=1SC9H7NO2c1610853247(8)9(11)126h25H1H3


BBL000103
Synonyms: 5-cyclohexyl-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)C1CCCCC1

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Nc1nnc(s1)C1CCCCC1

ZINC00147182

ZINC147182

134THIADIAZOLE2AMINO5CYCLOHEXYL

2AMINO5CICLOESIL134TIADIAZOLO

2AMINO5CYCLOHEXYL134THIADIAZOLE

4THIADIAZOLE2AMINO5CYCLOHEXYL3

5(CYCLOHEXYL)(134)THIADIAZOL2YLAMINE

56882770

5CYCLOHEXYL(134)THIADIAZOL2YLAMINE

5CYCLOHEXYL134THIADIAZOL2AMINE

5CYCLOHEXYL134THIADIAZOLE2YLAMINE

5CYCLOHEXYL2AMINO134THIADIAZOLE

C1CCC(CC1)C2=NN=C(S2)N

InChI=1SC8H13N3Sc9811107(128)6421356h6H15H2(H2911)


BBL000104
Synonyms: 4-oxo-4-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoicacid
Smiles: O=C(Nc1scc(n1)c1ccccc1)CCC(=O)O

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O=C(Nc1scc(n1)c1ccccc1)CCC(=O)O

ZINC000003236764

ZINC3236764

MFCD00298423

N(4PHENYLTHIAZOL2YL)SUCCINAMICACID

(Z)4OXO4((4PHENYLTHIAZOL2(3H)YLIDENE)AMINO)BUTANOICACID

3(N(4PHENYL13THIAZOL2YL)CARBAMOYL)PROPANOICACID

4OXO4(((2Z)4PHENYL13THIAZOL2(3H)YLIDENE)AMINO)BUTANOICACID

4OXO4((4PHENYL13THIAZOL2YL)AMINO)BUTANOICACID

4OXO4((4PHENYL2THIAZOLYL)AMINO)BUTANOICACID

4OXO4((4PHENYLTHIAZOL2YL)AMINO)BUTANOICACID

71576040

ACIDEN(PHENYL4THIAZOLYL2)SUCCINAMIQUE

ACIDEN(PHENYL4THIAZOLYL2)SUCCINAMIQUE(FRENCH)

BUTANOICACID4OXO4((4PHENYL2THIAZOLYL)AMINO)

C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCC(=O)O

InChI=1SC13H12N2O3Sc1611(6712(17)18)15131410(81913)9421359h158H67H2(H1718)(H141516)


BBL000105
Synonyms: (2-methyl-4-oxoquinazolin-3(4H)-yl)aceticacid
Smiles: OC(=O)Cn1c(C)nc2c(c1=O)cccc2

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OC(=O)Cn1c(C)nc2c(c1=O)cccc2

ZINC000000904178

ZINC904178

MFCD00197325

(2METHYL4OXO3(4H)QUINAZOLINYL)ACETICACID

(2METHYL4OXO4HQUINAZOLIN3YL)ACETICACID

(2METHYL4OXOQUINAZOLIN3(4H)YL)ACETICACID

(2METHYL4OXOQUINAZOLIN3YL)ACETICACID

2(2METHYL4OXO3HYDROQUINAZOLIN3YL)ACETICACID

2(2METHYL4OXOQUINAZOLIN3YL)ACETICACID

2METHYL4OXOQUINAZOLINE3(4H)ACETICACID

50844810

CC1=NC2=CC=CC=C2C(=O)N1CC(=O)O

InChI=1SC11H10N2O3c1712953248(9)11(16)13(7)610(14)15h25H6H21H3(H1415)


BBL000106
Synonyms: 5-pentyl-1,3,4-thiadiazol-2-amine
Smiles: CCCCCc1nnc(s1)N

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CCCCCc1nnc(s1)N

MFCD00727991

ZINC000001870940

ZINC01870940

ZINC1870940

134THIADIAZOL2AMINE5PENTYL

134THIADIAZOLE2AMINO5PENTYL

4THIADIAZOLE2AMINO5PENTYL3

52057906

5PENTYL(134)THIADIAZOL2YLAMINE

5PENTYL134THIADIAZOL2AMINE

5PENTYL134THIADIAZOL2YLAMINE

5PENTYL134THIADIAZOLE2AMINE

5PENTYL134THIADIAZOLE2YLAMINE

5PENTYL2AMINO134THIADIAZOLE

CCCCCC1=NN=C(S1)N

InChI=1SC7H13N3Sc1234569107(8)116h25H21H3(H2810)


BBL000107
Synonyms: 5-(2-chlorophenyl)-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)c1ccccc1Cl

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Nc1nnc(s1)c1ccccc1Cl

ZINC00193396

ZINC193396

134THIADIAZOL2AMINE5(2CHLOROPHENYL)

2AMINO5(2CHLOROPHENYL)(134)THIADIAZOLE

2AMINO5(2CHLOROPHENYL)134THIADIAZOLE

34THIADIAZOL2AMINE5(2CHLOROPHENYL)

5(2CHLOROPHENYL)(134)THIADIAZOL2YLAMINE

5(2CHLOROPHENYL)134THIADIAZOL2AMINE

5(2CHLOROPHENYL)134THIADIAZOLE2AMINE

5(2CHLOROPHENYL)134THIADIAZOLE2YLAMINE

828819

C1=CC=C(C(=C1)C2=NN=C(S2)N)Cl

InChI=1SC8H6ClN3Sc9642135(6)711128(10)137h14H(H21012)


BBL000108
Synonyms: 3'-aminobiphenyl-3-carboxylicacid
Smiles: Nc1cccc(c1)c1cccc(c1)C(=O)O

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Nc1cccc(c1)c1cccc(c1)C(=O)O

ZINC4245535

(11BIPHENYL)3CARBOXYLICACID3AMINO

124221712

3(3AMINOPHENYL)BENZOICACID

3AMINO(11BIPHENYL)3CARBOXYLICACID

3AMINO11BIPHENYL3CARBOXYLICACID

3AMINOBIPHENYL3CARBOXYLICACID

3BIPHENYL3AMINOCARBOXYLICACID


BBL000109
Synonyms: 4'-aminobiphenyl-3-carboxylicacid
Smiles: Nc1ccc(cc1)c1cccc(c1)C(=O)O

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Nc1ccc(cc1)c1cccc(c1)C(=O)O

ZINC000002522309

ZINC2522309

MFCD03990480

(11BIPHENYL)3CARBOXYLICACID4AMINO

3(4AMINOPHENYL)BENZOICACID

4AMINO(11BIPHENYL)3CARBOXYLICACID

4AMINO3BIPHENYLCARBOXYLICACID

4AMINOBIPHENYL3CARBOXYLICACID

85096044

C1=CC(=CC(=C1)C(=O)O)C2=CC=C(C=C2)N

InChI=1SC13H11NO2c1412649(5712)1021311(810)13(15)16h18H14H2(H1516)


BBL000110
Synonyms: 2'-aminobiphenyl-3-carboxylicacid
Smiles: Nc1ccccc1c1cccc(c1)C(=O)O

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Nc1ccccc1c1cccc(c1)C(=O)O

ZINC000002522307

ZINC2522307

MFCD03990478

(11BIPHENYL)3CARBOXYLICACID2AMINO

177171152

2AMINO(11BIPHENYL)3CARBOXYLICACID

2AMINO11BIPHENYL3CARBOXYLICACID

2AMINOBIPHENYL3CARBOXYLICACID

3(2AMINOPHENYL)BENZOICACID

C1=CC=C(C(=C1)C2=CC(=CC=C2)C(=O)O)N

InChI=1SC13H11NO2c1412721611(12)943510(89)13(15)16h18H14H2(H1516)


BBL000111
Synonyms: 2-(furan-2-yl)benzaldehyde
Smiles: O=Cc1ccccc1c1ccco1

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O=Cc1ccccc1c1ccco1

ZINC02522304

ZINC2522304

16191325

2(2FURANYL)BENZALDEHYDE

2(2FURYL)BENZALDEHYDE

2(FUR2YL)BENZALDEHYDE

2(FURAN2YL)BENZALDEHYDE

2FURAN2YLBENZALDEHYDE

2FURYLBENZALDEHYDE

BENZALDEHYDE2(2FURANYL)

C1=CC=C(C(=C1)C=O)C2=CC=CO2

InChI=1SC11H8O2c1289412510(9)116371311h18H


BBL000112
Synonyms: 4'-aminobiphenyl-4-carboxylicacid
Smiles: Nc1ccc(cc1)c1ccc(cc1)C(=O)O

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Nc1ccc(cc1)c1ccc(cc1)C(=O)O

ZINC000001746121

ZINC1746121

MFCD01138446

(11BIPHENYL)4CARBOXYLICACID4AMINO

4(4AMINOPHENYL)BENZOICACID

4AMINO(11BIPHENYL)4CARBOXYLICACID

4AMINO(11BIPHENYL)4CARBOXYLICACIDHYDROCHLORIDE

4AMINO4BIPHENYLCARBOXYLICACID

4AMINOBIPHENYL4CARBOXYLICACID

5730789

C1=CC(=CC=C1C2=CC=C(C=C2)N)C(=O)O

InChI=1SC13H11NO2c14127510(6812)91311(429)13(15)16h18H14H2(H1516)


BBL000113
Synonyms: 2-amino-7-(furan-2-yl)-7,8-dihydroquinazolin-5(6H)-one
Smiles: Nc1ncc2c(n1)CC(CC2=O)c1ccco1

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Nc1ncc2c(n1)CC(CC2=O)c1ccco1

299442436

2AMINO7(2FURANYL)78DIHYDRO6HQUINAZOLIN5ONE

2AMINO7(2FURYL)678TRIHYDROQUINAZOLIN5ONE

2AMINO7(2FURYL)78DIHYDRO5(6H)QUINAZOLINONE

2AMINO7(2FURYL)78DIHYDRO6HQUINAZOLIN5ONE

2AMINO7(2FURYL)78DIHYDROQUINAZOLIN5(6H)ONE

2AMINO7(FURAN2YL)78DIHYDRO6HQUINAZOLIN5ONE

2AMINO7(FURAN2YL)78DIHYDROQUINAZOLIN5(6H)ONE

2AMINO7(FURANYL)78DIHYDRO5(6H)QUINAZOLINONE

2AMINO7FURAN2YL78DIHYDRO6HQUINAZOLIN5ONE

2AZANYL7(FURAN2YL)78DIHYDRO6HQUINAZOLIN5ONE

ADENYLYLCYCLASETYPEVINHIBITOR

ADENYLYLCYCLASETYPEVINHIBITORNKY80

C1C(CC(=O)C2=CN=C(N=C21)N)C3=CC=CO3

InChI=1SC12H11N3O2c131214689(1512)47(510(8)16)112131711h1367H45H2(H2131415)


BBL000114
Synonyms: 2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Smiles: N#Cc1c(C)cc(nc1SCc1cc2OCOc2cc1Cl)C

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N#Cc1c(C)cc(nc1SCc1cc2OCOc2cc1Cl)C

ZINC000000371107

ZINC00371107

ZINC371107

MFCD02733350

2(((6CHLORO13BENZODIOXOL5YL)METHYL)SULFANYL)46DIMETHYLPYRIDINE3CARBONITRILE

2(((6CHLOROBENZO(D)(13)DIOXOL5YL)METHYL)THIO)46DIMETHYLNICOTINONITRILE

2((6CHLORANYL13BENZODIOXOL5YL)METHYLSULFANYL)46DIMETHYLPYRIDINE3CARBONITRILE

2((6CHLORO(2HBENZO(D)13DIOXOLAN5YL))METHYLTHIO)46DIMETHYLPYRIDINE3CARBONITRILE

2((6CHLORO13BENZODIOXOL5YL)METHYLSULFANYL)46DIMETHYLPYRIDINE3CARBONITRILE

2((6CHLORO13BENZODIOXOL5YL)METHYLTHIO)46DIMETHYL3PYRIDINECARBONITRILE

2((6CHLORO13BENZODIOXOL5YL)METHYLTHIO)46DIMETHYLNICOTINONITRILE

2(6CHLOROBENZO(13)DIOXOL5YLMETHYLSULFANYL)46DIMETHYLNICOTINONITRILE

299166395

CC1=CC(=NC(=C1C#N)SCC2=CC3=C(C=C2Cl)OCO3)C

InChI=1SC16H13ClN2O2Sc19310(2)1916(12(9)618)2271141415(513(11)17)2182014h35H78H212H3


BBL000115
Synonyms: [2,4-dibromo-5-(trifluoromethyl)phenyl]hydrazine
Smiles: NNc1cc(c(cc1Br)Br)C(F)(F)F

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NNc1cc(c(cc1Br)Br)C(F)(F)F

ZINC000002582500

ZINC02582500

ZINC2582500

(24DIBROMO5(TRIFLUOROMETHYL)PHENYL)HYDRAZINE

299165870

MFCD02663176

C1=C(C(=CC(=C1NN)Br)Br)C(F)(F)F

InChI=1SC7H5Br2F3N2c8425(9)6(1413)13(4)7(1011)12h1214H13H2


BBL000116
Synonyms: 5-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)c1ccc(c(c1)C)C

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Nc1nnc(s1)c1ccc(c(c1)C)C

ZINC00184297

ZINC184297

299936962

5(34DIMETHYLPHENYL)134THIADIAZOL2AMINE

CC1=C(C=C(C=C1)C2=NN=C(S2)N)C

InChI=1SC10H11N3Sc16348(57(6)2)9121310(11)149h35H12H3(H21113)


BBL000117
Synonyms: 5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)CSCc1ccccc1

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Nc1nnc(s1)CSCc1ccccc1

ZINC000000183408

ZINC00183408

ZINC183408

MFCD01191257

247225838

2AMINO5(BENZYLTHIOMETHYL)THIADIAZOLE

5((BENZYLSULFANYL)METHYL)134THIADIAZOL2AMINE

5((BENZYLTHIO)METHYL)134THIADIAZOL2AMINE

5((PHENYLMETHYLTHIO)METHYL)134THIADIAZOLE2YLAMINE

5(BENZYLSULFANYLMETHYL)134THIADIAZOL2AMINE

5BENZYLSULFANYLMETHYL(134)THIADIAZOL2YLAMINE

C1=CC=C(C=C1)CSCC2=NN=C(S2)N

InChI=1SC10H11N3S2c111013129(1510)71468421358h15H67H2(H21113)


BBL000118
Synonyms: 5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-amine
Smiles: COc1cc(ccc1OC)Cc1nnc(s1)N

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COc1cc(ccc1OC)Cc1nnc(s1)N

134THIADIAZOL2AMINE5((34DIMETHOXYPHENYL)METHYL)

313957856

5((34DIMETHOXYPHENYL)METHYL)134THIADIAZOL2AMINE

5(34DIMETHOXYBENZYL)(134)THIADIAZOL2YLAMINE

5(34DIMETHOXYBENZYL)134THIADIAZOL2AMINE

MFCD00980511

ZINC000000177413

ZINC00177413

ZINC177413

COC1=C(C=C(C=C1)CC2=NN=C(S2)N)OC

InChI=1SC11H13N3O2Sc1158437(59(8)162)610131411(12)1710h35H6H212H3(H21214)


BBL000119
Synonyms: 2-(furan-2-yl)benzoicacid
Smiles: OC(=O)c1ccccc1c1ccco1

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OC(=O)c1ccccc1c1ccco1

ZINC000002522306

ZINC2522306

MFCD03990477

2(2FURYL)BENZOICACID

2(FUR2YL)BENZOICACID

2(FURAN2YL)BENZOICACID

2FUR2YLBENZOICACID

2FURAN2YLBENZOICACID

331942473

BENZOICACID2(2FURANYL)

C1=CC=C(C(=C1)C2=CC=CO2)C(=O)O

InChI=1SC11H8O3c1211(13)952148(9)106371410h17H(H1213)


BBL000120
Synonyms: 2,3-dimethyl-6-azaspiro[4.5]decane
Smiles: CC1CC2(CC1C)CCCCN2

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CC1CC2(CC1C)CCCCN2

23DIMETHYL10AZASPIRO(45)DECANE

23DIMETHYL6AZASPIRO(45)DECANE

956784808

MFCD03990458

ZINC000002522289

ZINC000239073201

CC1CC2(CCCCN2)CC1C

InChI=1SC11H21Nc19711(810(9)2)53461211h91012H38H212H3


BBL000121
Synonyms: 4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)benzaldehyde
Smiles: C=CCc1cc(C=O)cc(c1O)OC

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C=CCc1cc(C=O)cc(c1O)OC

20240588

3ALLYL4HYDROXY5METHOXYBENZALDEHYDE

4HYDROXY3METHOXY5(PROP2EN1YL)BENZALDEHYDE

4HYDROXY3METHOXY5PROP2ENYLBENZALDEHYDE

BENZALDEHYDE4HYDROXY3METHOXY5(2PROPENYL)

MFCD01590282

ZINC000001461676

ZINC01461676

ZINC1461676

COC1=CC(=CC(=C1O)CC=C)C=O

InChI=1SC11H12O3c134958(712)610(142)11(9)13h35713H14H22H3


BBL000122
Synonyms: 2-(benzylamino)-2-methylpropan-1-ol
Smiles: OCC(NCc1ccccc1)(C)C

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OCC(NCc1ccccc1)(C)C

ZINC000005817218

ZINC5817218

MFCD04500950

NBENZYL2AMINO2METHYL1PROPANOL

(BENZYL)(2HYDROXY11DIMETHYLETHYL)AMINE

10250278

1PROPANOL2METHYL2((PHENYLMETHYL)AMINO)

2(BENZYLAMINO)2METHYL1PROPANOL

2(BENZYLAMINO)2METHYLPROPAN1OL

2(BENZYLAMINO)2METHYLPROPANOL

2BENZYLAMINO2METHYL1PROPANOL

2METHYL2((PHENYLMETHYL)AMINO)1PROPANOL

2METHYL2(BENZYLAMINO)1PROPANOL

CC(C)(CO)NCC1=CC=CC=C1

InChI=1SC11H17NOc111(2913)128106435710h371213H89H212H3


BBL000123
Synonyms: 4-[(pyridin-4-ylmethyl)amino]benzoicacid
Smiles: OC(=O)c1ccc(cc1)NCc1ccncc1

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OC(=O)c1ccc(cc1)NCc1ccncc1

ZINC528677

4((4PYRIDINYLMETHYL)AMINO)BENZOICACID

4((4PYRIDYLMETHYL)AMINO)BENZOICACID

4((PYRIDIN4YLMETHYL)AMINO)BENZOICACID

4(PYRIDIN4YLMETHYLAMINO)BENZOICACID

5966201

BENZOICACID4((4PYRIDINYLMETHYL)AMINO)

C1=CC(=CC=C1C(=O)O)NCC2=CC=NC=C2

InChI=1SC13H12N2O2c1613(17)111312(4211)1591057148610h1815H9H2(H1617)


BBL000124
Synonyms: (2E)-N-ethyl-3-phenylprop-2-en-1-amine
Smiles: CCNC/C=C/c1ccccc1

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CCNCC=Cc1ccccc1

(2E)NETHYL3PHENYLPROP2EN1AMINE

(E)NETHYL3PHENYLPROP2EN1AMINE

188049298

MFCD07405015

NETHYL3PHENYL2PROPEN1AMINE

NETHYL3PHENYLPROP2EN1AMINE

ZINC000008227090

ZINC8227090

CCNCC=CC1=CC=CC=C1

InChI=1SC11H15Nc12121069117435811h3912H210H21H3b96+


BBL000125
Synonyms: N-(pyridin-3-ylmethyl)propan-1-amine
Smiles: CCCNCc1cccnc1

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CCCNCc1cccnc1

19730133

MFCD07405051

N(3PYRIDINYLMETHYL)1PROPANAMINE

N(PYRIDIN3YLMETHYL)PROPAN1AMINE

NPROPYL3PYRIDINEMETHANAMINE

PROPYL(PYRIDIN3YLMETHYL)AMINE

ZINC000006869115

ZINC6869115

CCCNCC1=CN=CC=C1

InChI=1SC9H14N2c12510794361189h346810H257H21H3


BBL000126
Synonyms: 2-[4-(methylsulfonyl)piperazin-1-yl]aniline
Smiles: Nc1ccccc1N1CCN(CC1)S(=O)(=O)C

more...



Nc1ccccc1N1CCN(CC1)S(=O)(=O)C

PIPERAZINE1(2AMINOPHENYL)4(METHYLSULFONYL)

ZINC00555847

ZINC555847

(2(4(METHYLSULFONYL)PIPERAZIN1YL)PHENYL)AMINE

2(4(METHYLSULFONYL)PIPERAZIN1YL)ANILINE

2(4METHANESULFONYLPIPERAZIN1YL)PHENYLAMINE

2(4METHYLSULFONYLPIPERAZIN1YL)ANILINE

714282436

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2N

InChI=1SC11H17N3O2Sc117(1516)148613(7914)11532410(11)12h25H6912H21H3


BBL000127
Synonyms: [4-(2-amino-4-chlorophenyl)piperazin-1-yl](phenyl)methanone
Smiles: Clc1ccc(c(c1)N)N1CCN(CC1)C(=O)c1ccccc1

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Clc1ccc(c(c1)N)N1CCN(CC1)C(=O)c1ccccc1

(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)(PHENYL)METHANONE

(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)PHENYLMETHANONE

712293704

MFCD05811321

PIPERAZINE1(2AMINO4CHLOROPHENYL)4BENZOYL

ZINC000003882781

ZINC03882781

ZINC3882781

C1CN(CCN1C2=C(C=C(C=C2)Cl)N)C(=O)C3=CC=CC=C3

InChI=1SC17H18ClN3Oc18146716(15(19)1214)2081021(11920)17(22)134213513h1712H81119H2


BBL000128
Synonyms: 4-chloro-3-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Smiles: Nc1ccc(c(c1)c1nn2c(s1)nnc2C)Cl

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Nc1ccc(c(c1)c1nn2c(s1)nnc2C)Cl

ZINC04741150

ZINC4741150

4CHLORO3(3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)ANILINE

4CHLORO3(3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PHENYLAMINE

CC1=NN=C2N1N=C(S2)C3=C(C=CC(=C3)N)Cl

InChI=1SC10H8ClN5Sc1513141016(5)159(1710)746(12)238(7)11h24H12H21H3


BBL000129
Synonyms: 3-ethoxy-N-[(5-methylthiophen-2-yl)methyl]propan-1-amine
Smiles: CCOCCCNCc1ccc(s1)C

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CCOCCCNCc1ccc(s1)C

MFCD06010379

N(3ETHOXYPROPYL)N((5METHYL2THIENYL)METHYL)AMINE

N(3ETHOXYPROPYL)N((5METHYLTHIEN2YL)METHYL)AMINE

ZINC000002874451

ZINC2874451

(3ETHOXYPROPYL)((5METHYL(2THIENYL))METHYL)AMINE

(3ETHOXYPROPYL)((5METHYLTHIOPHEN2YL)METHYL)AMINE

(3ETHOXYPROPYL)(5METHYLTHIOPHEN2YLMETHYL)A

(3ETHOXYPROPYL)(5METHYLTHIOPHEN2YLMETHYL)AMINE

2THIOPHENEMETHANAMINEN(3ETHOXYPROPYL)5METHYL

3ETHOXYN((5METHYL2THIOPHENYL)METHYL)1PROPANAMINE

3ETHOXYN((5METHYLTHIOPHEN2YL)METHYL)PROPAN1AMINE

774551381

CCOCCCNCC1=CC=C(S1)C

InChI=1SC11H19NOSc1313847129116510(2)1411h5612H3479H212H3


BBL000130
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)amino]butan-1-ol
Smiles: CCC(NCc1ccc2c(c1)OCO2)CO

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CCC(NCc1ccc2c(c1)OCO2)CO

MFCD06006448

ZINC000004290947

ZINC000004290949

2((13BENZODIOXOL5YLMETHYL)AMINO)BUTAN1OL

2((2H13BENZODIOXOL5YLMETHYL)AMINO)BUTAN1OL

2((2HBENZO(34D)13DIOXOLAN5YLMETHYL)AMINO)BUTAN1OL

2((BENZO(13)DIOXOL5YLMETHYL)AMINO)BUTAN1OL

2(13BENZODIOXOL5YLMETHYLAMINO)BUTAN1OL

717830994

CCC(CO)NCC1=CC2=C(C=C1)OCO2

InChI=1SC12H17NO3c1210(714)1369341112(59)1681511h35101314H268H21H3


BBL000131
Synonyms: 1-{[(5-methylthiophen-2-yl)methyl]amino}propan-2-ol
Smiles: CC(CNCc1ccc(s1)C)O

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CC(CNCc1ccc(s1)C)O

MFCD04602589

PROPAN2OL1((5METHYLTHIOPHEN2YLMETHYL)AMINO)

ZINC000000360078

ZINC000000360079

1(((5METHYL2THIENYL)METHYL)AMINO)2PROPANOL

1(((5METHYL2THIENYL)METHYL)AMINO)PROPAN2OL

1(((5METHYLTHIEN2YL)METHYL)AMINO)PROPAN2OL

1(((5METHYLTHIOPHEN2YL)METHYL)AMINO)PROPAN2OL

1((5METHYLTHIOPHEN2YL)METHYLAMINO)PROPAN2OL

1((5METHYLTHIOPHEN2YLMETHYL)AMINO)PROPAN2

1((5METHYLTHIOPHEN2YLMETHYL)AMINO)PROPAN2OL

774191321

CC1=CC=C(S1)CNCC(C)O

InChI=1SC9H15NOSc17(11)51069438(2)129h3471011H56H212H3


BBL000132
Synonyms: N-(2-ethoxybenzyl)ethanamine
Smiles: CCNCc1ccccc1OCC

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CCNCc1ccccc1OCC

869942063

MFCD04588387

N((2ETHOXYPHENYL)METHYL)ETHANAMINE

N(2ETHOXYBENZYL)ETHANAMINE

N(2ETHOXYBENZYL)NETHYLAMINE

ZINC000008227314

ZINC8227314

CCNCC1=CC=CC=C1OCC

InChI=1SC11H17NOc1312910756811(10)1342h5812H349H212H3


BBL000133
Synonyms: 2-phenyl-N-(thiophen-2-ylmethyl)ethanamine
Smiles: c1ccc(cc1)CCNCc1cccs1

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c1ccc(cc1)CCNCc1cccs1

(2PHENYLETHYL)(2THIENYLMETHYL)AMINE

(2PHENYLETHYL)(THIOPHEN2YLMETHYL)AMINE

1135234397

2PHENYLN(THIOPHEN2YLMETHYL)ETHANAMINE

MFCD04587151

N(2PHENYLETHYL)N(2THIENYLMETHYL)AMINE

N(2PHENYLETHYL)N(THIEN2YLMETHYL)AMINE

PHENETHYLTHIOPHEN2YLMETHYLAMINE

ZINC000019371404

ZINC19371404

C1=CC=C(C=C1)CCNCC2=CC=CS2

InChI=1SC13H15NSc12512(631)8914111374101513h171014H8911H2


BBL000134
Synonyms: 2-methyl-2-[(pyridin-3-ylmethyl)amino]propan-1-ol
Smiles: OCC(NCc1cccnc1)(C)C

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OCC(NCc1cccnc1)(C)C

ZINC000005817219

ZINC5817219

MFCD04573186

2METHYL2((3PYRIDINYLMETHYL)AMINO)1PROPANOL

2METHYL2((3PYRIDINYLMETHYL)AMINO)1PROPANOL95

2METHYL2((PYRIDIN3YLMETHYL)AMINO)PROPAN1OL

2METHYL2(AMINO)1PROPANOL

2METHYL2(PYRIDIN3YLMETHYLAMINO)PROPAN1OL

893615231

CC(C)(CO)NCC1=CN=CC=C1

InChI=1SC10H16N2Oc110(2813)12794351169h361213H78H212H3


BBL000135
Synonyms: 1-[2-(benzyloxy)phenyl]-N-methylmethanamine
Smiles: CNCc1ccccc1OCc1ccccc1

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CNCc1ccccc1OCc1ccccc1

1(2(BENZYLOXY)PHENYL)NMETHYLMETHANAMINE

869946952

MFCD04536859

N(2(BENZYLOXY)BENZYL)NMETHYLAMINE

NMETHYL1(2PHENYLMETHOXYPHENYL)METHANAMINE

ZINC000005910047

ZINC5910047

CNCC1=CC=CC=C1OCC2=CC=CC=C2

InChI=1SC15H17NOc11611149561015(14)1712137324813h21016H1112H21H3


BBL000136
Synonyms: N-(4-ethoxybenzyl)propan-1-amine
Smiles: CCCNCc1ccc(cc1)OCC

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CCCNCc1ccc(cc1)OCC

((4ETHOXYPHENYL)METHYL)(PROPYL)AMINE

869942621

MFCD04526889

N((4ETHOXYPHENYL)METHYL)PROPAN1AMINE

N(4ETHOXYBENZYL)NPROPYLAMINE

N(4ETHOXYBENZYL)PROPAN1AMINE

ZINC000007262377

ZINC7262377

CCCNCC1=CC=C(C=C1)OCC

InChI=1SC12H19NOc1391310115712(8611)1442h5813H34910H212H3


BBL000137
Synonyms: N-(pyridin-4-ylmethyl)propan-1-amine
Smiles: CCCNCc1ccncc1

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CCCNCc1ccncc1

4PYRIDINEMETHANAMINENPROPYL

70065815

MFCD04489485

N(4PYRIDINYLMETHYL)1PROPANAMINE

N(PYRIDIN4YLMETHYL)PROPAN1AMINE

NPROPYL4PYRIDINEMETHANAMINE

PROPYL(4PYRIDYLMETHYL)AMINE

PROPYL(PYRIDIN4YLMETHYL)AMINE

ZINC000006869116

ZINC6869116

CCCNCC1=CC=NC=C1

InChI=1SC9H14N2c12511893610749h346711H258H21H3


BBL000138
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-ethoxypropan-1-amine
Smiles: CCOCCCNCc1ccc2c(c1)OCO2

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CCOCCCNCc1ccc2c(c1)OCO2

(2H13BENZODIOXOL5YLMETHYL)(3ETHOXYPROPYL)AMINE

(2HBENZO(34D)13DIOXOLAN5YLMETHYL)(3ETHOXYPROPYL)AMINE

774551369

BENZO(13)DIOXOL5YLMETHYL(3ETHOXYPROPYL)AMIN

BENZO(13)DIOXOL5YLMETHYL(3ETHOXYPROPYL)AMINE

MFCD04478438

N(13BENZODIOXOL5YLMETHYL)3ETHOXYPROPAN1AMINE

N(13BENZODIOXOL5YLMETHYL)N(3ETHOXYPROPYL)AMINE

ZINC000004298688

ZINC4298688

CCOCCCNCC1=CC2=C(C=C1)OCO2

InChI=1SC13H19NO3c121573614911451213(811)17101612h45814H2367910H21H3


BBL000139
Synonyms: 6-ethoxy-1,3-benzothiazol-2-amine
Smiles: CCOc1ccc2c(c1)sc(n2)N

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CCOc1ccc2c(c1)sc(n2)N

ZINC13099329

2AMINO6ETHOXYBENZOTHIAZOLE

2AMINO6ETHOXYBENZOTHIAZOLEHCL

2BENZOTHIAZOLAMINE6ETHOXY

2BENZOTHIAZOLAMINE6ETHOXY(9CI)

6ETHOXY13BENZOTHIAZOL2AMINE

6ETHOXY13BENZOTHIAZOL2YLAMINE

6ETHOXY2AMINOBENZOTHIAZOLE

6ETHOXY2BENZOTHIAZOLAMINE

6ETHOXYBENZOTHIAZOL2AMINE

6ETHOXYBENZOTHIAZOL2YLAMINE

6ETHOXYBENZOTHIAZOLE2YLAMINE

94451

BENZOTHIAZOLE2AMINO6ETHOXY

BENZOTHIAZOLE2AMINO6ETHOXY(8CI)

CCOC1=CC2=C(C=C1)N=C(S2)N

InChI=1SC9H10N2OSc121263478(56)139(10)117h35H2H21H3(H21011)


BBL000140
Synonyms: 2-hydrazinyl-6-methoxy-1,3-benzothiazole
Smiles: COc1ccc2c(c1)sc(n2)NN

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COc1ccc2c(c1)sc(n2)NN

HYDRAZINOMETHOXYBENZOTHIAZOLE

MFCD01439956

ZINC000002379952

ZINC02379952

ZINC2379952

(6METHOXY13BENZOTHIAZOL2YL)HYDRAZINE

(6METHOXYBENZOTHIAZOL2YL)HYDRAZINE

1(6METHOXYBENZOTHIAZOL2YL)HYDRAZINE

2(3H)BENZOTHIAZOLONE6METHOXYHYDRAZONE(9CI)2HYDRAZINO6METHOXY13BENZOTHIAZOLE(EN)

20174703

2HYDRAZINO6METHOXY13BENZOTHIAZOLE

2HYDRAZINO6METHOXYBENZOTHIAZOLE

2HYDRAZINYL6METHOXY13BENZOTHIAZOLE

2HYDRAZINYL6METHOXYBENZO(D)THIAZOLE

2HYDRAZINYL6METHOXYBENZOTHIAZOLE

2HYRAZINYL6METHOXYBENZO(D)THIAZOLE

6METHOXYBENZOTHIAZOLE2YLHYDRAZINE

BENZOTHIAZOLE2HYDRAZINYL6METHOXY

COC1=CC2=C(C=C1)N=C(S2)NN

InChI=1SC8H9N3OSc11252367(45)138(106)119h24H9H21H3(H1011)


BBL000141
Synonyms: [5-(4-bromophenyl)furan-2-yl]methanol
Smiles: OCc1ccc(o1)c1ccc(cc1)Br

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OCc1ccc(o1)c1ccc(cc1)Br

ZINC00118230

ZINC118230

(5(4BROMOPHENYL)2FURYL)METHAN1OL

(5(4BROMOPHENYL)2FURYL)METHANOL

(5(4BROMOPHENYL)FURAN2YL)METHANOL

2FURANMETHANOL5(4BROMOPHENYL)

33342288

C1=CC(=CC=C1C2=CC=C(O2)CO)Br

InChI=1SC11H9BrO2c129318(249)116510(713)1411h1613H7H2


BBL000142
Synonyms: 5-iodo-6-methylpyridin-2-amine
Smiles: Nc1ccc(c(n1)C)I

more...



Nc1ccc(c(n1)C)I

ZINC18271218

2AMINO5IODO6METHYLPYRIDINE

2AMINO5IODO6PICOLINE

2METHYL3IODO6AMINOPYRIDINE

5IODO6METHYL2PYRIDINAMINE

5IODO6METHYL2PYRIDYLAMINE

5IODO6METHYLPYRIDIN2AMINE

5IODO6METHYLPYRIDIN2YLAMINE

5IODO6METHYLPYRIDINE2AMINE

6AMINO3IODO2METHYLPYRIDINE

6AMINO3IODO2PICOLINE

6AMINO3IODO2PICOLINE5IODO6METHYL2PYRIDINAMINE

75073119

CC1=C(C=CC(=N1)N)I

InChI=1SC6H7IN2c145(7)236(8)94h23H1H3(H289)


BBL000143
Synonyms: 5-(3-chloro-4-methylphenyl)furan-2-carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(c(c1)Cl)C

more...



O=Cc1ccc(o1)c1ccc(c(c1)Cl)C

ZINC000000333529

ZINC00333529

ZINC333529

2FURANCARBOXALDEHYDE5(3CHLORO4METHYLPHENYL)

5(3CHLORO4METHYLPHENYL)2FURALDEHYDE

5(3CHLORO4METHYLPHENYL)2FURALDEHYDE95

5(3CHLORO4METHYLPHENYL)FURAN2CARBALDEHYDE

57666532

MFCD00579049

CC1=C(C=C(C=C1)C2=CC=C(O2)C=O)Cl

InChI=1SC12H9ClO2c18239(611(8)13)125410(714)1512h27H1H3


BBL000144
Synonyms: [5-(3,4-dichlorophenyl)furan-2-yl]methanol
Smiles: OCc1ccc(o1)c1ccc(c(c1)Cl)Cl

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OCc1ccc(o1)c1ccc(c(c1)Cl)Cl

ZINC000000523638

ZINC00523638

ZINC523638

MFCD02257991

(5(34DICHLOROPHENYL)2FURYL)METHAN1OL

(5(34DICHLOROPHENYL)2FURYL)METHANOL

(5(34DICHLOROPHENYL)FURAN2YL)METHANOL

2FURANMETHANOL5(34DICHLOROPHENYL)

353509281

5(34DICHLOROPHENYL)FURFURYLALCOHOL

C1=CC(=C(C=C1C2=CC=C(O2)CO)Cl)Cl

InChI=1SC11H8Cl2O2c129317(510(9)13)11428(614)1511h1514H6H2


BBL000145
Synonyms: [5-(2,5-dichlorophenyl)furan-2-yl]methanol
Smiles: OCc1ccc(o1)c1cc(Cl)ccc1Cl

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OCc1ccc(o1)c1cc(Cl)ccc1Cl

ZINC000000529974

ZINC00529974

ZINC529974

(5(25DICHLOROPHENYL)2FURYL)METHAN1OL

(5(25DICHLOROPHENYL)FURAN2YL)METHANOL

2FURANMETHANOL5(25DICHLOROPHENYL)

585522141

MFCD02624798

C1=CC(=C(C=C1Cl)C2=CC=C(O2)CO)Cl

InChI=1SC11H8Cl2O2c1271310(13)9(57)11428(614)1511h1514H6H2


BBL000146
Synonyms: 2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine
Smiles: CC(NCc1ccncc1)(C)C

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CC(NCc1ccncc1)(C)C

N(TERTBUTYL)N(PYRIDIN4YLMETHYL)AMINE

ZINC5817177

2METHYLN(4PYRIDINYLMETHYL)2PROPANAMINE

2METHYLN(4PYRIDINYLMETHYL)2PROPANAMINE95

2METHYLN(PYRIDIN4YLMETHYL)PROPAN2AMINE

341008295

CC(C)(C)NCC1=CC=NC=C1

InChI=1SC10H16N2c110(23)12894611759h4712H8H213H3


BBL000147
Synonyms: 3-[(pyridin-4-ylmethyl)amino]propan-1-ol
Smiles: OCCCNCc1ccncc1

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OCCCNCc1ccncc1

ZINC000001692505

ZINC1692505

MFCD00023633

3((4PYRIDINYLMETHYL)AMINO)1PROPANOL

3((4PYRIDYLMETHYL)AMINO)PROPAN1OL

3((PYRIDIN4YLMETHYL)AMINO)PROPAN1OL

3(4PYRIDYLMETHYLAMINO)1PROPANOL

3(AMINO)PROPAN1OL

3(PYRIDIN4YLMETHYLAMINO)PROPAN1OL

7251629

C1=CN=CC=C1CNCCCO

InChI=1SC9H14N2Oc1271411892510639h23561112H1478H2


BBL000148
Synonyms: 1-[4-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]methanamine
Smiles: CCc1ccc2c(c1)nc(o2)c1ccc(cc1)CN

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CCc1ccc2c(c1)nc(o2)c1ccc(cc1)CN

MFCD05843331

ZINC000012855215

ZINC12855215

(4(5ETHYLBENZOXAZOL2YL)PHENYL)METHYLAMINE

1(4(5ETHYL13BENZOXAZOL2YL)PHENYL)METHANAMINE

4(5ETHYLBENZOOXAZOL2YL)BENZYLAMINE

875000105

(4(5ethyl13benzoxazol2yl)phenyl)methanamine

CCC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)CN

InChI=1SC16H16N2Oc1211581514(911)1816(1915)136312(1017)4713h39H21017H21H3


BBL000149
Synonyms: N-[(5-methylthiophen-2-yl)methyl]-3-(morpholin-4-yl)propan-1-amine
Smiles: Cc1ccc(s1)CNCCCN1CCOCC1

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Cc1ccc(s1)CNCCCN1CCOCC1

((5METHYL(2THIENYL))METHYL)(3MORPHOLIN4YLPROPYL)AMINE

((5METHYLTHIOPHEN2YL)METHYL)(3(MORPHOLIN4YL)PROPYL)AMINE

(5METHYLTHIOPHEN2YLMETHYL)(3MORPHOLIN4YLP

(5METHYLTHIOPHEN2YLMETHYL)(3MORPHOLIN4YLPROPYL)AMINE

1052426353

MFCD04540145

N((5METHYL2THIENYL)METHYL)N(3(4MORPHOLINYL)PROPYL)AMINE

N((5METHYLTHIEN2YL)METHYL)N(3MORPHOLIN4YLPROPYL)AMINE

N((5METHYLTHIOPHEN2YL)METHYL)3(MORPHOLIN4YL)PROPAN1AMINE

N((5METHYLTHIOPHEN2YL)METHYL)3MORPHOLIN4YLPROPAN1AMINE

ZINC000095098707

ZINC95098707

CC1=CC=C(S1)CNCCCN2CCOCC2

InChI=1SC13H22N2OSc1123413(1712)111452615791610815h3414H2511H21H3


BBL000150
Synonyms: N-(pyridin-3-ylmethyl)butan-2-amine
Smiles: CCC(NCc1cccnc1)C

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CCC(NCc1cccnc1)C

869941708

BUTAN2YL(PYRIDIN3YLMETHYL)AMINE

MFCD04519340

N(3PYRIDINYLMETHYL)2BUTAMINE

N(3PYRIDINYLMETHYL)2BUTANAMINE

N(3PYRIDINYLMETHYL)2BUTANAMINE95

N(PYRIDIN3YLMETHYL)BUTAN2AMINE

ZINC000005823176

ZINC000005823235

CCC(C)NCC1=CN=CC=C1

InChI=1SC10H16N2c139(2)1281054611710h47912H38H212H3


BBL000151
Synonyms: 2-(5-formylfuran-2-yl)benzonitrile
Smiles: O=Cc1ccc(o1)c1ccccc1C#N

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O=Cc1ccc(o1)c1ccccc1C#N

ZINC04313146

ZINC4313146

2(5FORMYL2FURYL)BENZENECARBONITRILE

2(5FORMYL2FURYL)BENZONITRILE

2(5FORMYL2FURYL)BENZONITRILE95

2(5FORMYLFURAN2YL)BENZONITRILE

299442232

BENZONITRILE2(5FORMYL2FURANYL)

C1=CC=C(C(=C1)C#N)C2=CC=C(O2)C=O

InChI=1SC12H7NO2c1379312411(9)126510(814)1512h168H


BBL000152
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-(morpholin-4-yl)propan-1-amine
Smiles: C(NCc1ccc2c(c1)OCO2)CCN1CCOCC1

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C(NCc1ccc2c(c1)OCO2)CCN1CCOCC1

(2HBENZO(34D)13DIOXOLEN5YLMETHYL)(3MORPHOLIN4YLPROPYL)AMINE

774553478

BENZO(13)DIOXOL5YLMETHYL(3MORPHOLIN4YLPROP

BENZO(13)DIOXOL5YLMETHYL(3MORPHOLIN4YLPROPYL)AMINE

MFCD00427645

N(13BENZODIOXOL5YLMETHYL)3(MORPHOLIN4YL)PROPAN1AMINE

N(13BENZODIOXOL5YLMETHYL)3MORPHOLIN4YLPROPAN1AMINE

ZINC000002885390

ZINC2885390

C1COCCN1CCCNCC2=CC3=C(C=C2)OCO3

InChI=1SC15H22N2O3c1(51768189717)4161113231415(1013)20121914h231016H1491112H2


BBL000153
Synonyms: 1-[4-(2-aminophenyl)piperazin-1-yl]ethanone
Smiles: CC(=O)N1CCN(CC1)c1ccccc1N

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CC(=O)N1CCN(CC1)c1ccccc1N

ETHANONE1(4(2AMINOPHENYL)1PIPERAZINYL)

1(4(2AMINOPHENYL)PIPERAZIN1YL)ETHANONE

1(4PIPERAZIN1YL)ETHANONE

1ACETYL4(2AMINOPHENYL)PIPERAZINE

2(4ACETYL1PIPERAZINYL)PHENYLAMINE

2(4ACETYLPIPERAZIN1YL)ANILINE

91646456

PIPERAZINE1ACETYL4(2AMINOPHENYL)

ZINC00533049

ZINC533049

CC(=O)N1CCN(CC1)C2=CC=CC=C2N

InChI=1SC12H17N3Oc110(16)146815(9714)12532411(12)13h25H6913H21H3


BBL000154
Synonyms: [4-(2-aminophenyl)piperazin-1-yl](phenyl)methanone
Smiles: Nc1ccccc1N1CCN(CC1)C(=O)c1ccccc1

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Nc1ccccc1N1CCN(CC1)C(=O)c1ccccc1

PIPERAZINE1(OAMINOPHENYL)4BENZOYL

ZINC00533110

ZINC533110

(4(2AMINOPHENYL)PIPERAZIN1YL)(PHENYL)METHANONE

(4(2AMINOPHENYL)PIPERAZIN1YL)PHENYLMETHANONE

4(2AMINOPHENYL)PIPERAZINYLPHENYLKETONE

93730315

C1CN(CCN1C2=CC=CC=C2N)C(=O)C3=CC=CC=C3

InChI=1SC17H19N3Oc1815845916(15)19101220(131119)17(21)146213714h19H101318H2


BBL000155
Synonyms: 5-oxo-1-propylpyrrolidine-3-carboxylicacid
Smiles: CCCN1CC(CC1=O)C(=O)O

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CCCN1CC(CC1=O)C(=O)O

208118234

4(3H)QUINAZOLINONE2((3HYDROXYPROPYL)AMINO)

5OXO1PROPYLPYRROLIDINE3CARBOXYLICACID

MFCD00661184

ZINC000005246815

ZINC000005246819

InChI=1SC8H13NO3c123956(8(11)12)47(9)10h6H25H21H3(H1112)


BBL000156
Synonyms: 5-methoxy-2-(morpholin-4-yl)aniline
Smiles: COc1ccc(c(c1)N)N1CCOCC1

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COc1ccc(c(c1)N)N1CCOCC1

5METHOXY2(MORPHOLIN4YL)ANILINE

5METHOXY2MORPHOLIN4YLPHENYLAMINE

5METHOXY2MORPHOLINOANILINE

897548195

ZINC08701851

ZINC8701851

5methoxy2morpholin4ylaniline

COC1=CC(=C(C=C1)N2CCOCC2)N

InChI=1SC11H16N2O2c11492311(10(12)89)1346157513h238H4712H21H3


BBL000157
Synonyms: (3Z)-3-(hydroxyimino)-1,3-dihydro-2H-indol-2-one
Smiles: O/N=C/1\C(=O)Nc2c1cccc2

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ON=C1C(=O)Nc2c1cccc2

ZINC111389148

ZINC18149198

(3Z)1HINDOLE23DIONE3OXIME

(3Z)3(HYDROXYIMINO)13DIHYDRO2HINDOL2ONE

(3Z)3(HYDROXYIMINO)1HINDOL2ONE

(3Z)3(OXIDOLAMBDA5AZANYLIDENE)13DIHYDRO2HINDOL2ONE

(3Z)3HYDROXYIMINOINDOLIN2ONE

1HINDOLE23DIONE3OXIME

1HINDOLE23DIONE3OXIME(3Z)

1HINDOLE23DIONE3OXIME(9CI)

1HINDOLE23DIONE3OXIME(Z)

1HINDOLE23OXIME

3(HYDROXYAMINO)2HINDOL2ONE

3(HYDROXYAMINO)INDOL2ONE

3(HYDROXYIMINO)1HBENZO(D)AZOLIN2ONE

3(HYDROXYIMINO)1HINDOL2ONE

3(HYDROXYIMINO)23DIHYDRO1HINDOL2ONE

3(HYDROXYIMINO)2INDOLINONE

3(HYDROXYIMINO)INDOLIN2ONE

3HYDROXYIMINOINDOLIN2ONE

3ISATINOXIME

3OXIMEINDOLE23DIONE

607283

(3E)1HINDOLE23DIONE3OXIME

(3E)3(HYDROXYIMINO)23DIHYDRO1HINDOL2ONE

INDOLE23DIONE3OXIME

INDOLE23OXIME

ISATIN3OXIME

ISATINBETAOXIME

ISATINOXIME

C1=CC2=C(C(=O)N=C2C=C1)NO

InChI=1SC8H6N2O2c1187(1012)531246(5)98h1412H(H91011)


BBL000158
Synonyms: (5Z)-5-(3-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1NC(=O)/C(=C/c2cccc(c2)O)/S1

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S=C1NC(=O)C(=Cc2cccc(c2)O)S1

ZINC000012407284

ZINC12407284

MFCD00022417

(5Z)5((3HYDROXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE

(5Z)5(3HYDROXYBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE

(Z)5(3HYDROXYBENZYLIDENE)2THIOXOTHIAZOLIDIN4ONE

37530351

5((3HYDROXYPHENYL)METHYLENE)2THIOXO13THIAZOLIDIN4ONE

5(MHYDROXYBENZYLIDENE)RHODANINE

52THIOXOTHIAZOLIDIN4ONE

C1=CC(=CC(=C1)O)C=C2C(=O)NC(=S)S2

InChI=1SC10H7NO2S2c1273126(47)589(13)1110(14)158h1512H(H111314)b85


BBL000159
Synonyms: 4-(4-methoxyphenyl)-1,3-thiazol-2-amine
Smiles: COc1ccc(cc1)c1csc(n1)N

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COc1ccc(cc1)c1csc(n1)N

THIAZOL2AMINE4(4METHOXYPHENYL)

THIAZOL2AMINE6

THIAZOLE2AMINO4(PMETHOXYPHENYL)

ZINC01508401

ZINC1508401

03042104

2AMINO4(4METHOXYPHENYL)13THIAZOLE

2AMINO4(4METHOXYPHENYL)THIAZOLE

2AMINO4(PMETHOXYPHENYL)THIAZOLE

2THIAZOLAMINE4(4METHOXYPHENYL)

4(4METHOXYPHENYL)13THIAZOL2AMINE

4(4METHOXYPHENYL)13THIAZOLE2YLAMINE

4(4METHOXYPHENYL)2THIAZOLAMINE

4(4METHOXYPHENYL)THIAZOL2AMINE

4(4METHOXYPHENYL)THIAZOL2YLAMINE

COC1=CC=C(C=C1)C2=CSC(=N2)N

InChI=1SC10H10N2OSc1138427(358)961410(11)129h26H1H3(H21112)


BBL000160
Synonyms: 2-(2-formyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: O=Cc1cccn1c1sc2c(c1C#N)CCCC2

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O=Cc1cccn1c1sc2c(c1C#N)CCCC2

2(2formyl1Hpyrrol1yl)4567tetrahydro1benzothiophene3carbonitrile

352553630

ZINC02565445

ZINC2565445

2(2formylpyrrol1yl)4567tetrahydro1benzothiophene3carbonitrile

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3C=O)C#N

InChI=1SC14H12N2OSc1581211512613(11)1814(12)1673410(16)917h3479H1256H2


BBL000161
Synonyms: [5-(4-methoxy-2-nitrophenyl)furan-2-yl]methanol
Smiles: COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)CO

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COc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)CO

(5(2NITRO4METHOXYPHENYL)2FURYL)METHANOL

(5(4METHOXY2NITROPHENYL)2FURYL)METHANOL

(5(4METHOXY2NITROPHENYL)FURAN2YL)METHANOL

2FURANMETHANOL5(4METHOXY2NITROPHENYL)

353509292

MFCD02168270

ZINC000000360901

ZINC00360901

ZINC360901

COC1=CC(=C(C=C1)C2=CC=C(O2)CO)(N+)(=O)(O)

InChI=1SC12H11NO5c11782410(11(68)13(15)16)12539(714)1812h2614H7H21H3


BBL000162
Synonyms: (2E)-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enoicacid
Smiles: OC(=O)/C=C/c1ccc(o1)c1ccc(cc1[N+](=O)[O-])C

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OC(=O)C=Cc1ccc(o1)c1ccc(cc1(N+)(=O)(O))C

ZINC000004294426

ZINC4294426

MFCD06666162

(2E)3(5(4METHYL2NITROPHENYL)2FURYL)ACRYLICACID

(2E)3(5(4METHYL2NITROPHENYL)FURAN2YL)PROP2ENOICACID

(E)3(5(4METHYL2NITROPHENYL)FURAN2YL)ACRYLICACID

(E)3(5(4METHYL2NITROPHENYL)FURAN2YL)PROP2ENOICACID

3(5(4METHYL2NITROPHENYL)FURAN2YL)ACRYLICACID

792947058

CC1=CC(=C(C=C1)C2=CC=C(O2)C=CC(=O)O)(N+)(=O)(O)

InChI=1SC14H11NO5c192511(12(89)15(18)19)136310(2013)4714(16)17h28H1H3(H1617)b74+


BBL000163
Synonyms: [5-(3-amino-4-ethoxyphenyl)furan-2-yl]methanol
Smiles: CCOc1ccc(cc1N)c1ccc(o1)CO

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CCOc1ccc(cc1N)c1ccc(o1)CO

(5(3AMINO4ETHOXYPHENYL)2FURYL)METHAN1OL

(5(3AMINO4ETHOXYPHENYL)2FURYL)METHANOL

(5(3AMINO4ETHOXYPHENYL)FURAN2YL)METHANOL

2FURANMETHANOL5(3AMINO4ETHOXYPHENYL)

875001493

MFCD07138527

ZINC000004748669

ZINC04748669

ZINC4748669

CCOC1=C(C=C(C=C1)C2=CC=C(O2)CO)N

InChI=1SC13H15NO3c121613539(711(13)14)126410(815)1712h3715H2814H21H3


BBL000164
Synonyms: 1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]propan-1-one
Smiles: CCC(=O)N1CCN(CC1)c1ccc(cc1Cl)N

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CCC(=O)N1CCN(CC1)c1ccc(cc1Cl)N

(3CHLORO4(4PROPIONYLPIPERAZIN1YL)PHENYL)AMINE

1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)PROPAN1ONE

838613755

PIPERAZINE1(4AMINO2CHLOROPHENYL)4(1OXOPROPYL)

ZINC01070228

ZINC1070228

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N)Cl

InChI=1SC13H18ClN3Oc1213(18)177516(6817)124310(15)911(12)14h349H25815H21H3


BBL000165
Synonyms: N-(6-amino-1,3-benzothiazol-2-yl)butanamide
Smiles: CCCC(=O)Nc1nc2c(s1)cc(cc2)N

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CCCC(=O)Nc1nc2c(s1)cc(cc2)N

833430301

BUTANAMIDEN(6AMINO2BENZOTHIAZOLYL)

MFCD05843344

N(6AMINO13BENZOTHIAZOL2YL)BUTANAMIDE

N(6AMINOBENZOTHIAZOL2YL)BUTYRAMIDE

NBUTYRAMIDE

ZINC000001067805

ZINC01067805

ZINC1067805

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)N

InChI=1SC11H13N3OSc12310(15)1411138547(12)69(8)1611h46H2312H21H3(H131415)


BBL000166
Synonyms: [5-(4-amino-2-chlorophenyl)furan-2-yl]methanol
Smiles: OCc1ccc(o1)c1ccc(cc1Cl)N

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OCc1ccc(o1)c1ccc(cc1Cl)N

ZINC000004298857

ZINC04298857

ZINC4298857

(5(4AMINO2CHLOROPHENYL)2FURYL)METHAN1OL

(5(4AMINO2CHLOROPHENYL)2FURYL)METHANOL

(5(4AMINO2CHLOROPHENYL)FURAN2YL)METHANOL

2FURANMETHANOL5(4AMINO2CHLOROPHENYL)

874468549

MFCD05843273

C1=CC(=C(C=C1N)Cl)C2=CC=C(O2)CO

InChI=1SC11H10ClNO2c121057(13)139(10)11428(614)1511h1514H613H2


BBL000167
Synonyms: (2E)-3-[5-(4-bromo-2-chlorophenyl)furan-2-yl]prop-2-enoicacid
Smiles: OC(=O)/C=C/c1ccc(o1)c1ccc(cc1Cl)Br

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OC(=O)C=Cc1ccc(o1)c1ccc(cc1Cl)Br

ZINC000008729536

ZINC8729536

MFCD05843247

(2E)3(5(4BROMO2CHLOROPHENYL)FURAN2YL)PROP2ENOICACID

(E)3(5(4BROMO2CHLOROPHENYL)FURAN2YL)ACRYLICACID

874592377

(E)3(5(4bromo2chlorophenyl)furan2yl)prop2enoicacid

C1=CC(=C(C=C1Br)Cl)C2=CC=C(O2)C=CC(=O)O

InChI=1SC13H8BrClO3c1481410(11(15)78)12529(1812)3613(16)17h17H(H1617)b63+


BBL000168
Synonyms: 4-amino-2-(5-chloro-1,3-benzoxazol-2-yl)-6-methylphenol
Smiles: Clc1ccc2c(c1)nc(o2)c1cc(N)cc(c1O)C

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Clc1ccc2c(c1)nc(o2)c1cc(N)cc(c1O)C

4amino2(5chloro13benzoxazol2yl)6methylphenol

874592173

MFCD05843216

ZINC000004412668


BBL000169
Synonyms: 4-amino-2-methyl-6-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenol
Smiles: Nc1cc(C)c(c(c1)c1nc2c(o1)ccc(c2)C(C)C)O

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Nc1cc(C)c(c(c1)c1nc2c(o1)ccc(c2)C(C)C)O

4amino2methyl6(5(propan2yl)13benzoxazol2yl)phenol

874592140

MFCD05843212

ZINC000004412665


BBL000170
Synonyms: 3-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylaniline
Smiles: CCc1nnc2n1nc(s2)c1cccc(c1C)N

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CCc1nnc2n1nc(s2)c1cccc(c1C)N

ZINC04414576

ZINC4414576

(3(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYL)AMINE

3(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLANILINE

3(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYLAMINE

3(3ETHYL(124TRIAZOLO(34B)134THIADIAZOLIN6YL))2METHYLPHENYLAMINE

874591567

CCC1=NN=C2N1N=C(S2)C3=C(C(=CC=C3)N)C

InChI=1SC12H13N5Sc131014151217(10)1611(1812)85469(13)7(8)2h46H313H212H3


BBL000171
Synonyms: 4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylaniline
Smiles: CCc1nnc2n1nc(s2)c1ccc(c(c1)C)N

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CCc1nnc2n1nc(s2)c1ccc(c(c1)C)N

ZINC04414573

ZINC4414573

4(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLANILINE

4(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYLAMINE

4(3ETHYL(124TRIAZOLO(34B)134THIADIAZOLIN6YL))2METHYLPHENYLAMINE

874468505

CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)N)C

InChI=1SC12H13N5Sc131014151217(10)1611(1812)8459(13)7(2)68h46H313H212H3


BBL000172
Synonyms: (2E)-3-[5-(4-methoxy-3-nitrophenyl)furan-2-yl]prop-2-enoicacid
Smiles: COc1ccc(cc1[N+](=O)[O-])c1ccc(o1)/C=C/C(=O)O

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COc1ccc(cc1(N+)(=O)(O))c1ccc(o1)C=CC(=O)O

MFCD03848241

ZINC000000531989

ZINC531989

(2E)3(5(4METHOXY3NITROPHENYL)FURAN2YL)PROP2ENOICACID

(E)3(5(4METHOXY3NITROPHENYL)FURAN2YL)ACRYLICACID

(E)3(5(4METHOXY3NITROPHENYL)FURAN2YL)PROP2ENOICACID

843620655

COC1=C(C=C(C=C1)C2=CC=C(O2)C=CC(=O)O)(N+)(=O)(O)

InChI=1SC14H11NO6c12013529(811(13)15(18)19)126310(2112)4714(16)17h28H1H3(H1617)b74+


BBL000173
Synonyms: 4-amino-N-(butan-2-yl)benzenesulfonamide
Smiles: CCC(NS(=O)(=O)c1ccc(cc1)N)C

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CCC(NS(=O)(=O)c1ccc(cc1)N)C

MFCD04035142

ZINC000000874833

ZINC000000874835

((4AMINOPHENYL)SULFONYL)(METHYLPROPYL)AMINE

4AMINON(BUTAN2YL)BENZENE1SULFONAMIDE

4AMINON(BUTAN2YL)BENZENESULFONAMIDE

4AMINON(SECBUTYL)BENZENESULFONAMIDE

4AMINONBUTAN2YLBENZENESULFONAMIDE

4AMINONSECBUTYLBENZENESULFONAMIDE

59724582

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)N

InChI=1SC10H16N2O2Sc138(2)1215(1314)10649(11)5710h4812H311H212H3


BBL000174
Synonyms: 1-(4-nitrophenyl)-1H-pyrrole
Smiles: [O-][N+](=O)c1ccc(cc1)n1cccc1

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(O)(N+)(=O)c1ccc(cc1)n1cccc1

1(1HPYRROL1YL)4NITROBENZENE

1(4(HYDROXY(OXIDO)AMINO)PHENYL)1HPYRROLE

1(4NITROPHENYL)1HPYRROLE

1(4NITROPHENYL)PYRROLE

1(PNITROPHENYL)PYRROLE

4533420

NITROPHENYLPYRROLE

ZINC00138289

ZINC138289

(4NITROPHENYL)PYRROLE

C1=CN(C=C1)C2=CC=C(C=C2)(N+)(=O)(O)

InChI=1SC10H8N2O2c1312(14)10539(4610)11712811h18H


BBL000175
Synonyms: 3-(phenylsulfanyl)propanoicacid
Smiles: OC(=O)CCSc1ccccc1

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OC(=O)CCSc1ccccc1

PHENYLSULFANYLPROPANOICACID

PROPANOICACID3(PHENYLTHIO)

ZINC000000082300

ZINC82300

MFCD00215509

3(PHENYLSULFANYL)PROPANACID

3(PHENYLSULFANYL)PROPANOICACID

3(PHENYLSULPHANYL)PROPIONICACID

3(PHENYLTHIO)PROPANOICACID

3(PHENYLTHIO)PROPIONICACID

3PHENYLSULFANYLPROPANOICACID

3PHENYLSULFANYLPROPIONICACID

3PHENYLTHIOPROPANOICACID

5219658

BETA(PHENYLMERCAPTO)PROPIONICACID

C1=CC=C(C=C1)SCCC(=O)O

InChI=1SC9H10O2Sc109(11)67128421358h15H67H2(H1011)


BBL000176
Synonyms: 3-methyl-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Cc1nnc2n1nc(s2)c1ccccc1

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Cc1nnc2n1nc(s2)c1ccccc1

3METHYL6PHENYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

43029409

ZINC09205212

ZINC9205212

CC1=NN=C2N1N=C(S2)C3=CC=CC=C3

InChI=1SC10H8N4Sc1711121014(7)139(1510)8532468h26H1H3


BBL000177
Synonyms: 3-(3,5-dimethyl-1H-pyrazol-1-yl)propanal
Smiles: Cc1cc(nn1CCC=O)C

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Cc1cc(nn1CCC=O)C

ZINC08549354

ZINC8549354

1HPYRAZOLE1PROPANAL35DIMETHYL

3(35DIMETHYL1HPYRAZOL1YL)PROPANAL

3(35DIMETHYLPYRAZOL1YL)PROPANAL

947404899


BBL000178
Synonyms: 3-bromo-5-chloro-2-hydroxybenzaldehyde
Smiles: O=Cc1cc(Cl)cc(c1O)Br

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O=Cc1cc(Cl)cc(c1O)Br

ZINC000000122906

ZINC00122906

ZINC122906

MFCD00051690

19652325

2BROMO4CHLORO6FORMYLPHENOL

3BROMO5CHLORO2HYDROXYBENZALDEHYDE

3BROMO5CHLOROOHYDROXYBENZALDEHYDE

3BROMO5CHLOROSALICYCLICALDEHYDE

3BROMO5CHLOROSALICYLALDEHYDE

3BROMO5CHLOROSALICYLICALDEHYDE

BENZALDEHYDE3BROMO5CHLORO2HYDROXY

C1=C(C=C(C(=C1Br)O)C=O)Cl

InChI=1SC7H4BrClO2c8625(9)14(310)7(6)11h1311H


BBL000179
Synonyms: N-phenylbenzenecarbothioamide
Smiles: S=C(c1ccccc1)Nc1ccccc1

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S=C(c1ccccc1)Nc1ccccc1

THIOBENZANILIDE

ZINC000000028345

ZINC00028345

ZINC28345

636044

BENZANILIDETHIO

BENZENECARBOTHIOAMIDENPHENYL

MFCD00022147

NPHENYLBENZENECARBOTHIOAMIDE

NPHENYLTHIOBENZAMIDE

PHENYL(PHENYLAMINO)METHANE1THIONE

C1=CC=C(C=C1)C(=S)NC2=CC=CC=C2

InChI=1SC13H11NSc1513(117314811)141295261012h110H(H1415)


BBL000180
Synonyms: [(4-chlorophenyl)sulfanyl]aceticacid
Smiles: OC(=O)CSc1ccc(cc1)Cl

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OC(=O)CSc1ccc(cc1)Cl

PCHLOROPHENYLMERCAPTOACETICACID

PCHLOROPHENYLTHIOACETICACID

ZINC000000075397

ZINC75397

MFCD00021762

((4CHLOROPHENYL)SULFANYL)ACETICACID

((4CHLOROPHENYL)THIO)ACETICACID

((PCHLOROPHENYL)THIO)ACETICACID

(4CHLOROPHENYLSULFANYL)ACETICACID

(4CHLOROPHENYLTHIO)ACETICACID

2((4CHLOROPHENYL)SULFANYL)ACETICACID

2((4CHLOROPHENYL)THIO)ACETICACID

2(4CHLOROPHENYL)SULFANYLACETICACID

2(4CHLOROPHENYLTHIO)ACETICACID

2(PCHLOROPHENYLTHIO)ACETICACID

3405887

ACETICACID((4CHLOROPHENYL)THIO)

ACETICACID((4CHLOROPHENYL)THIO)(9CI)

ACETICACID((PCHLOROPHENYL)THIO)

ALPHA(PCHLOROPHENYLMERCAPTO)ACETICACID

ALPHA(PCHLOROPHENYLTHIO)ACETICACID

C1=CC(=CC=C1SCC(=O)O)Cl

InChI=1SC8H7ClO2Sc96137(426)1258(10)11h14H5H2(H1011)


BBL000181
Synonyms: 4-[(furan-2-ylcarbonyl)amino]benzoicacid
Smiles: O=C(c1ccco1)Nc1ccc(cc1)C(=O)O

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O=C(c1ccco1)Nc1ccc(cc1)C(=O)O

ZINC000000123862

ZINC123862

MFCD00522706

4((FURAN2CARBONYL)AMINO)BENZOICACID

4((FURAN2YLCARBONYL)AMINO)BENZOICACID

4(2FURAMIDO)BENZOICACID

4(2FUROYLAMINO)BENZOICACID

4(2FURYLCARBONYLAMINO)BENZOICACID

4(FURAN2AMIDO)BENZOICACID

4(FURAN2CARBONYLAMINO)BENZOICACID

4(FURAN2CARBOXAMIDO)BENZOICACID

5768343

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O

InChI=1SC12H9NO4c1411(102171710)139538(469)12(15)16h17H(H1314)(H1516)


BBL000182
Synonyms: 3-(benzylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-amine
Smiles: Nn1c(SCc2ccccc2)nnc1C

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Nn1c(SCc2ccccc2)nnc1C

ZINC00305871

ZINC305871

(3(BENZYLTHIO)5METHYL124TRIAZOL4YL)AMINE

3(BENZYLSULFANYL)5METHYL4H124TRIAZOL4AMINE

3(BENZYLTHIO)5METHYL4H124TRIAZOL4AMINE

3(BENZYLTHIO)5METHYL4H124TRIAZOLE4AMINE

3BENZYLSULFANYL5METHYL(124)TRIAZOL4YLAMINE

3BENZYLSULFANYL5METHYL124TRIAZOL4AMINE

3METHYL5(PHENYLMETHYLSULFANYL)124TRIAZOL4AMINE

3METHYL5(PHENYLMETHYLTHIO)124TRIAZOL4AMINE

4H124TRIAZOL4AMINE3METHYL5((PHENYLMETHYL)THIO)

90871402

CC1=NN=C(N1N)SCC2=CC=CC=C2

InChI=1SC10H12N4Sc18121310(14(8)11)1579532469h26H711H21H3


BBL000183
Synonyms: ethyl2-(acetylamino)-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)C

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CCOC(=O)c1c(scc1c1ccccc1)NC(=O)C

ETHYL2(ACETYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE

ETHYL2ACETAMIDO4PHENYLTHIOPHENE3CARBOXYLATE

13130375

2ACETYLAMINO3ETHOXYCARBONYL4PHENYLTHIOPHENE

2ACETYLAMINO4PHENYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

MFCD00426588

ZINC000000041914

ZINC00041914

ZINC41914

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C

InChI=1SC15H15NO3Sc131915(18)1312(117546811)92014(13)1610(2)17h49H3H212H3(H1617)


BBL000184
Synonyms: N,N-dimethyl-N'-[4-(propan-2-yl)benzyl]propane-1,3-diamine
Smiles: CN(CCCNCc1ccc(cc1)C(C)C)C

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CN(CCCNCc1ccc(cc1)C(C)C)C

DIMETHYL(3(((4(METHYLETHYL)PHENYL)METHYL)AMINO)PROPYL)AMINE

(3(DIMETHYLAMINO)PROPYL)((4ISOPROPYLPHENYL)METHYL)AMINE

1158646106

MFCD02127680

N(3(DIMETHYLAMINO)PROPYL)N(4ISOPROPYLBENZYL)AMINE

N(4ISOPROPYLBENZYL)NNDIMETHYL13PROPANE

N(4ISOPROPYLBENZYL)NNDIMETHYL13PROPANEDIAMINE

N(4ISOPROPYLBENZYL)NNDIMETHYLPROPANE13DIAMINE

NNDIMETHYLN((4PROPAN2YLPHENYL)METHYL)PROPANE13DIAMINE

NNDIMETHYLN(4(PROPAN2YL)BENZYL)PROPANE13DIAMINE

ZINC000002373649

ZINC2373649

CC(C)C1=CC=C(C=C1)CNCCCN(C)C

InChI=1SC15H26N2c113(2)158614(7915)12161051117(3)4h691316H51012H214H3


BBL000185
Synonyms: 6-(4-chlorobenzyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1ccc(cc1)Cc1nn2c(s1)nnc2

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Clc1ccc(cc1)Cc1nn2c(s1)nnc2

ZINC04487478

ZINC4487478

6((4CHLOROPHENYL)METHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE

6((4CHLOROPHENYL)METHYL)124TRIAZOLO(34B)134THIADIAZOLINE

6(4CHLOROBENZYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE

876885471

C1=CC(=CC=C1CC2=NN3C=NN=C3S2)Cl

InChI=1SC10H7ClN4Sc118317(248)5914156121310(15)169h146H5H2


BBL000186
Synonyms: 2-phenyl-1H-benzimidazole
Smiles: c1ccc(cc1)c1nc2c([nH]1)cccc2

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c1ccc(cc1)c1nc2c((nH)1)cccc2

MFCD00005592

PHENYLBENZIMIDAZOLE

ZINC000000001932

ZINC00001932

ZINC1932

1HBENZIMIDAZOLE2PHENYL

1HBENZIMIDAZOLEPHENYL

1PHENYLBENZIMIDAZOLEANALOG6

2PHENYL1H13BENZODIAZOLE

2PHENYL1HBENZIMIDAZOLE

2PHENYL1HBENZO(D)IMIDAZOLE

2PHENYL1HBENZOIMIDAZOLE

2PHENYLBENZIMDAZOLE

2PHENYLBENZIMIDAZOLE

716790

BENZIMIDAZOLE2PHENYL

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2

InChI=1SC13H10N2c12610(731)131411845912(11)1513h19H(H1415)


BBL000187
Synonyms: 3,5-dibromopyridin-2-amine
Smiles: Brc1cnc(c(c1)Br)N

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Brc1cnc(c(c1)Br)N

MFCD00038041

PYRIDINE2AMINO35DIBROMO

ZINC000018995549

ZINC18995549

2AMINO35DIBROMOPYRIDINE

2PYRIDINAMINE35DIBROMO

35486421

35DIBROMO2AMINOPYRIDINE

35DIBROMO2PYRIDINAMINE

35DIBROMO2PYRIDINYLAMINE

35DIBROMO2PYRIDYLAMINE

35DIBROMOPYRIDIN2AMINE

35DIBROMOPYRIDIN2YLAMINE

35DIBROMOPYRIDINE2AMINE

35DIBROMPYRIDIN2AMIN

C1=C(C=NC(=C1Br)N)Br

InChI=1SC5H4Br2N2c6314(7)5(8)923h12H(H289)


BBL000188
Synonyms: piperazine-1,4-diylbis(furan-2-ylmethanone)
Smiles: O=C(c1ccco1)N1CCN(CC1)C(=O)c1ccco1

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O=C(c1ccco1)N1CCN(CC1)C(=O)c1ccco1

PIPERAZINE14BIS(2FURANYLCARBONYL)

PIPERAZINE14BIS(2FURANYLCARBONYL)(9CI)

PIPERAZINE14DIYLBIS(FURAN2YLMETHANONE)

TERAZOSINHYDROCHLORIDEDIHYDRATESPECIFIEDIMPURITYM(EP)

ZINC000000156403

ZINC00156403

ZINC156403

(4(FURAN2CARBONYL)PIPERAZIN1YL)(FURAN2YL)METHANONE

(4(FURAN2CARBONYL)PIPERAZIN1YL)FURAN2YLMETHANONE

14BIS(2FUROYL)PIPERAZINE

14BIS(FURAN2YLCARBONYL)PIPERAZINE

14DI(2FUROYL)PIPERAZINE

14DI2FUROYLPIPERAZINE

2FURYL(4(2FURYLCARBONYL)PIPERAZINO)METHANONE

2FURYL4(2FURYLCARBONYL)PIPERAZINYLKETONE

31350273

MFCD00428410

C1CN(CCN1C(=O)C2=CC=CO2)C(=O)C3=CC=CO3

InChI=1SC14H14N2O4c1713(113191911)155716(8615)14(18)1242102012h14910H58H2


BBL000189
Synonyms: 2-methyl-1-phenyl-1H-benzimidazole-5-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)nc(n2c1ccccc1)C

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OC(=O)c1ccc2c(c1)nc(n2c1ccccc1)C

ZINC000000062099

ZINC62099

MFCD00218479

1HBENZIMIDAZOLE5CARBOXYLICACID2METHYL1PHENYL

2METHYL1PHENYL13BENZODIAZOLE5CARBOXYLICACID

2METHYL1PHENYL1H13BENZODIAZOLE5CARBOXYLICACID

2METHYL1PHENYL1HBENZIMIDAZOLE5CARBOXYLICACID

2METHYL1PHENYL1HBENZO(D)IMIDAZOLE5CARBOXYLICACID

2METHYL1PHENYL1HBENZOIMIDAZOLE5CARBOXYLIC

2METHYL1PHENYL1HBENZOIMIDAZOLE5CARBOXYLICACID

2METHYL1PHENYLBENZIMIDAZOLE5CARBOXYLICACID

92437439

BENZIMIDAZOLE5CARBOXYLICACID2METHYL1PHENYL

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)O

InChI=1SC15H12N2O2c1101613911(15(18)19)7814(13)17(10)125324612h29H1H3(H1819)


BBL000190
Synonyms: 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1

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OC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1

ZINC000008468327

ZINC000100147479

ZINC000100824706

MFCD00415604

4(133A477AHEXAHYDRO13DIOXO47METHANO2HISOINDOL2YL)BENZOICACID

4(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)BENZOICACID

4(13DIOXO3A477ATETRAHYDRO1H47METHANOISOINDOL2(3H)YL)BENZOICACID

4(3A477ATETRAHYDRO13DIOXO47METHANOISOINDOLINE2YL)BENZOICACID

55099100

BENZOICACID4(233A477AHEXAHYDRO47METHANO13DIOXO2ISOINDOLYL)

C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O

InChI=1SC16H13NO4c18141291210(79)13(12)15(19)17(14)11538(4611)16(20)21h169101213H7H2(H2021)


BBL000191
Synonyms: 1-(4-chloro-2-nitrophenyl)piperazine
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])N1CCNCC1

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Clc1ccc(c(c1)(N+)(=O)(O))N1CCNCC1

ZINC3877852

(4CHLORO2NITROPHENYL)PIPERAZINE

1(4CHLORO2NITROPHENYL)PIPERAZINE

405910341

C1CN(CCN1)C2=C(C=C(C=C2)Cl)(N+)(=O)(O)

InChI=1SC10H12ClN3O2c118129(10(78)14(15)16)1353124613h12712H36H2


BBL000192
Synonyms: 1-(2-chloro-6-nitrophenyl)piperazine
Smiles: Clc1cccc(c1N1CCNCC1)[N+](=O)[O-]

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Clc1cccc(c1N1CCNCC1)(N+)(=O)(O)

(2CHLORO6NITROPHENYL)PIPERAZINE

(6CHLORO2NITROPHENYL)PIPERAZINE

1(2CHLORO6NITROPHENYL)PIPERAZINE

1(2CHLORO6NITROPHENYL)PIPERAZINE95

3CHLORO2(PIPERAZIN1YL)NITROBENZENE

5749393

MFCD01173865

PIPERAZINE1(2CHLORO6NITROPHENYL)

ZINC000004132190

ZINC4132190

C1CN(CCN1)C2=C(C=CC=C2Cl)(N+)(=O)(O)

InChI=1SC10H12ClN3O2c1182139(14(15)16)10(8)1364125713h1312H47H2


BBL000193
Synonyms: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-4-methoxyaniline
Smiles: COc1ccc(cc1)NCC1OCc2c(CO1)cccc2

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COc1ccc(cc1)NCC1OCc2c(CO1)cccc2

(1H3H5HBENZO(E)13DIOXEPAN3YLMETHYL)(4METHOXYPHENYL)AMINE

(59DIHYDRO68DIOXABENZOCYCLOHEPTEN7YLMETHYL)(4METHOXYPHENYL)AMINE

24BENZODIOXEPIN3METHANAMINE15DIHYDRON(4METHOXYPHENYL)

312585470

MFCD01909798

N((15DIHYDROBENZO(E)(13)DIOXEPIN3YL)METHYL)4METHOXYANILINE

N(15DIHYDRO24BENZODIOXEPIN3YLMETHYL)4METHOXYANILINE

N(35DIHYDRO1H24BENZODIOXEPIN3YLMETHYL)4METHOXYANILINE

ZINC000000258218

ZINC00258218

ZINC258218

COC1=CC=C(C=C1)NCC2OCC3=CC=CC=C3CO2

InChI=1SC17H19NO3c119168615(7916)181017201113423514(13)122117h291718H1012H21H3


BBL000194
Synonyms: 4-{[(thiophen-2-ylmethyl)amino]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CNCc1cccs1

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OC(=O)c1ccc(cc1)CNCc1cccs1

ZINC000004657610

ZINC04657610

ZINC4657610

MFCD05881929

4(((2THIENYLMETHYL)AMINO)METHYL)BENZOICACID

4(((2THIENYLMETHYL)AMINO)METHYL)BENZOICACIDHYDROCHLORIDE

4(((THIOPHEN2YLMETHYL)AMINO)METHYL)BENZOICACID

4((THIOPHEN2YLMETHYLAMINO)METHYL)BENZOICACID

4((THIOPHEN2YLMETHYLAZANIUMYL)METHYL)BENZOATE

775293373

C1=CSC(=C1)CNCC2=CC=C(C=C2)C(=O)O

InChI=1SC13H13NO2Sc1513(16)115310(4611)8149122171712h1714H89H2(H1516)


BBL000195
Synonyms: 1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]-3-methylbutan-1-one
Smiles: CC(CC(=O)N1CCN(CC1)c1ccc(cc1Cl)N)C

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CC(CC(=O)N1CCN(CC1)c1ccc(cc1Cl)N)C

PIPERAZINE1(4AMINO2CHLOROPHENYL)4(3METHYL1OXOBUTYL)

ZINC04741881

ZINC4741881

(3CHLORO4(4(3METHYLBUTANOYL)PIPERAZIN1YL)PHENYL)AMINE

1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)3METHYLBUTAN1ONE

3CHLORO4(4(3METHYLBUTANOYL)1PIPERAZINYL)PHENYLAMINE

879020323

CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N)Cl

InChI=1SC15H22ClN3Oc111(2)915(20)197518(6819)144312(17)1013(14)16h341011H5917H212H3


BBL000196
Synonyms: (2E)-1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]-3-phenylprop-2-en-1-one
Smiles: Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)/C=C/c1ccccc1

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Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)C=Cc1ccccc1

ZINC000004741882

ZINC04741882

ZINC4741882

MFCD07626921

(2E)1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)3PHENYLPROP2EN1ONE

(3CHLORO4(4CINNAMOYLPIPERAZIN1YL)PHENYL)AMINE

(E)1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)3PHENYLPROP2EN1ONE

(E)1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)3PHENYLPROPENONE

3CHLORO4(4CINNAMOYL1PIPERAZINYL)PHENYLAMINE

879020356

C1CN(CCN1C2=C(C=C(C=C2)N)Cl)C(=O)C=CC3=CC=CC=C3

InChI=1SC19H20ClN3Oc20171416(21)7818(17)22101223(131122)19(24)96154213515h1914H101321H2b96+


BBL000197
Synonyms: 1H-1,2,3-triazole-4,5-dicarboxylicacid
Smiles: OC(=O)c1[nH]nnc1C(=O)O

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OC(=O)c1(nH)nnc1C(=O)O

ZINC000003900783

ZINC3900783

MFCD00005246

123TRIAZOLE45DICARBOXYLICACID

1H123TRIAZOLE45DICARBOXYLICACID

1HTRIAZOLE45DICARBOXYLICACID

2H123TRIAZOLE45DICARBOXYLICACID

2HTRIAZOLE45DICARBOXYLICACID

4546956

45DICARBOXY123TRIAZOLE

C1(=NNN=C1C(=O)O)C(=O)O

InChI=1SC4H3N3O4c83(9)12(4(10)11)6751h(H89)(H1011)(H567)


BBL000198
Synonyms: 3-amino-3-(3-methoxyphenyl)propanoicacid
Smiles: COc1cccc(c1)C(CC(=O)O)N

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COc1cccc(c1)C(CC(=O)O)N

DL3AMINO3(3METHOXYPHENYL)PROPIONICACID

MFCD00462569

PROPIONICACID3AMINO3(4METHOXYPHENYL)

ZINC000000112489

ZINC000003678210

(S)3AMINO3(3METHOXYPHENYL)PROPIONICACID

3(3METHOXYPHENYL)BETAALANINE

3AMINO3(3METHOXYPHENYL)PROPANOICACID

3AMINO3(3METHOXYPHENYL)PROPIONICACID

3AMMONIO3(3METHOXYPHENYL)PROPANOATE

68208195

BENZENEPROPANOICACIDBAMINO3METHOXY

BETAAMINO3METHOXYBENZENEPROPANOICACID

COC1=CC=CC(=C1)C(CC(=O)O)N

InChI=1SC10H13NO3c11484237(58)9(11)610(12)13h259H611H21H3(H1213)


BBL000199
Synonyms: 5-(1,3-benzoxazol-2-yl)-2-methoxyaniline
Smiles: COc1ccc(cc1N)c1nc2c(o1)cccc2

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COc1ccc(cc1N)c1nc2c(o1)cccc2

2(3AMINO4METHOXYPHENYL)BENZOXAZOLE

378222481

5(13BENZOXAZOL2YL)2METHOXYANILINE

5BENZOOXAZOL2YL2METHOXYPHENYLAMINE

5BENZOXAZOL2YL2METHOXYPHENYLAMINE

BENZENAMINE5(2BENZOXAZOLYL)2METHOXY

MFCD00298038

ZINC000000154610

ZINC00154610

ZINC154610

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N

InChI=1SC14H12N2O2c11712769(810(12)15)141611423513(11)1814h28H15H21H3


BBL000200
Synonyms: (1,3-benzothiazol-2-ylsulfanyl)aceticacid
Smiles: OC(=O)CSc1nc2c(s1)cccc2

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OC(=O)CSc1nc2c(s1)cccc2

S2(BENZOTHIAZOLYLTHIO)GLYCOLICACID

S2BENZOTHIAZOLYLTHIOGLYCOLICACID

ZINC000000113984

ZINC113984

MFCD00227391

((13BENZOTHIAZOL2YL)SULPHANYL)ACETICACID

(13BENZOTHIAZOL2YLSULFANYL)ACETICACID

(13BENZOTHIAZOL2YLTHIO)ACETICACID

(2BENZOTHIAZOLYLTHIO)ACETICACID

(2BENZOTHIAZOLYTHIO)ACETICACID

(BENZOTHIAZOL2YLSULFANYL)ACETICACID

(BENZOTHIAZOL2YLTHIO)ACETICACID

2(13BENZOTHIAZOL2YLSULFANYL)ACETICACID

2(2BENZOTHIAZOLYLTHIO)ACETICACID

2(BENZO(D)THIAZOL2YLTHIO)ACETICACID

2(CARBOXYMETHYLTHIO)BENZOTHIAZOLE

2BENZOTHIAZOL2YLTHIOACETICACID

2CARBOXYMETHYLTHIOBENZOTHIAZOLE

6295574

ACETICACID(2BENZOTHIAZOLYLTHIO)

ACETICACID2(2BENZOTHIAZOLYLTHIO)

BENZOTHIAZOL2YLSULFANYLACETICACID

C1=CC=C2C(=C1)N=C(S2)SCC(=O)O

InChI=1SC9H7NO2S2c118(12)513910631247(6)149h14H5H2(H1112)


BBL000201
Synonyms: 2,3-dibromo-5-ethoxy-6-hydroxybenzaldehyde
Smiles: CCOc1cc(Br)c(c(c1O)C=O)Br

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CCOc1cc(Br)c(c(c1O)C=O)Br

20041649

23DIBROMO5ETHOXY6HYDROXYBENZALDEHYDE

BENZALDEHYDE3DIBROMO5ETHOXY6HYDROXY

MFCD00297095

ZINC000000291212

ZINC00291212

ZINC291212

CCOC1=CC(=C(C(=C1O)C=O)Br)Br

InChI=1SC9H8Br2O3c1214736(10)8(11)5(412)9(7)13h3413H2H21H3


BBL000202
Synonyms: 4-(piperidin-1-yl)aniline
Smiles: Nc1ccc(cc1)N1CCCCC1

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Nc1ccc(cc1)N1CCCCC1

ZINC00152886

ZINC152886

N(4AMINOPHENYL)PIPERIDINE

(4PIPERID1YLPHENYL)AMINE

(4PIPERIDIN1YLPHENYL)AMINE

1(4AMINOPHENYL)PIPERIDINE

2359606

4(1PIPERIDINO)ANILINE

4(1PIPERIDINYL)ANILINE

4(1PIPERIDYL)ANILINE

4(PIPERIDIN1YL)ANILINE

4(PIPERIDIN1YL)PHENYLAMINE

4PIPERIDIN1YLANILINE

4PIPERIDIN1YLPHENYLAMINE

4PIPERIDINOANILINE

4PIPERIDYLPHENYLAMINE

BENZENAMINE4(1PIPERIDINYL)

C1CCN(CC1)C2=CC=C(C=C2)N

InChI=1SC11H16N2c12104611(7510)138213913h47H138912H2


BBL000203
Synonyms: 2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)aniline
Smiles: Cc1ccc2c(c1)nc(o2)c1cccc(c1C)N

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Cc1ccc2c(c1)nc(o2)c1cccc(c1C)N

292058549

2METHYL3(5METHYL13BENZOXAZOL2YL)ANILINE

2METHYL3(5METHYLBENZOOXAZOL2YL)PHENYLAMINE

2METHYL3(5METHYLBENZOXAZOL2YL)PHENYLAMINE

BENZENAMINE2METHYL3(5METHYL2BENZOXAZOLYL)

MFCD00298095

ZINC000000154836

ZINC00154836

ZINC154836

CC1=CC2=C(C=C1)OC(=N2)C3=C(C(=CC=C3)N)C

InChI=1SC15H14N2Oc19671413(89)1715(1814)1143512(16)10(11)2h38H16H212H3


BBL000204
Synonyms: N-(3-aminophenyl)-2-methylpropanamide
Smiles: O=C(C(C)C)Nc1cccc(c1)N

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O=C(C(C)C)Nc1cccc(c1)N

PROPANAMIDEN(3AMINOPHENYL)2METHYL

ZINC000000570137

ZINC00570137

ZINC570137

213831006

MFCD02258054

N(3AMINOPHENYL)2METHYLPROPANAMIDE

N(3AMINOPHENYL)ISOBUTYRAMIDE

CC(C)C(=O)NC1=CC=CC(=C1)N

InChI=1SC10H14N2Oc17(2)10(13)1295348(11)69h37H11H212H3(H1213)


BBL000205
Synonyms: 5-bromo-3-chloro-2-hydroxybenzaldehyde
Smiles: O=Cc1cc(Br)cc(c1O)Cl

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O=Cc1cc(Br)cc(c1O)Cl

ZINC000003765052

ZINC03765052

ZINC3765052

19652336

3CHLORO5BROMOSALICYLALDEHYDE

5BROMO3CHLORO2HYDROXYBENZALDEHYDE

MFCD00807894

C1=C(C=C(C(=C1Cl)O)C=O)Br

InChI=1SC7H4BrClO2c8514(310)7(11)6(9)25h1311H


BBL000206
Synonyms: 2-(4-ethylphenyl)-6-methyl-2H-benzotriazol-5-amine
Smiles: CCc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

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CCc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

MFCD03032047

ZINC000000279698

ZINC00279698

ZINC279698

(2(4ETHYLPHENYL)6METHYLBENZOTRIAZOL5YL)AMINE

2(4ETHYLPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4ETHYLPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4ETHYLPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2(4ETHYLPHENYL)6METHYL5BENZOTRIAZOLAMINE

2(4ETHYLPHENYL)6METHYLBENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4ETHYLPHENYL)6METHYL

443291790

CCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C

InChI=1SC15H16N4c13114612(7511)191714810(2)13(16)915(14)1819h49H316H212H3


BBL000207
Synonyms: 2-(4-fluorophenyl)-6-methyl-2H-benzotriazol-5-amine
Smiles: Fc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

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Fc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

MFCD03031569

ZINC000000339550

ZINC00339550

ZINC339550

(2(4FLUOROPHENYL)6METHYLBENZOTRIAZOL5YL)AMINE

2(4FLUOROPHENYL)6METHYL123BENZOTRIAZOL5AMINE

2(4FLUOROPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4FLUOROPHENYL)6METHYL2HBENZO(D)(123)TRIAZOL5AMINE

2(4FLUOROPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4FLUOROPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2(4FLUOROPHENYL)6METHYL2HYDROBENZOTRIAZOLE5YLAMINE

2(4FLUOROPHENYL)6METHYL5BENZOTRIAZOLAMINE

2(4FLUOROPHENYL)6METHYLBENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4FLUOROPHENYL)6METHYL

436086849

CC1=CC2=NN(N=C2C=C1N)C3=CC=C(C=C3)F

InChI=1SC13H11FN4c1861213(711(8)15)1718(1612)10429(14)3510h27H15H21H3


BBL000208
Synonyms: 2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1cccc2c1cccc2Cl

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Nc1ccc2c(c1)nc(o2)c1cccc2c1cccc2Cl

ZINC000000202095

ZINC00202095

ZINC202095

2(5CHLORO1NAPHTHYL)13BENZOXAZOL5AMINE

2(5CHLORONAPHTHALEN1YL)13BENZOXAZOL5AMINE

2(5CHLORONAPHTHALEN1YL)BENZOOXAZOL5YLAMINE

443289563

5BENZOXAZOLAMINE2(5CHLORO1NAPHTHALENYL)

MFCD03031301

C1=CC2=C(C=CC=C2Cl)C(=C1)C3=NC4=C(O3)C=CC(=C4)N

InChI=1SC17H11ClN2Oc18146231112(14)41513(11)172015910(19)7816(15)2117h19H19H2


BBL000209
Synonyms: 2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-amine
Smiles: COc1ccc(cc1Cl)n1nc2c(n1)cc(c(c2)N)C

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COc1ccc(cc1Cl)n1nc2c(n1)cc(c(c2)N)C

MFCD02628416

ZINC000003772117

ZINC03772117

ZINC3772117

2(3CHLORO4METHOXYPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(3CHLORO4METHOXYPHENYL)6METHYL2HBENZO(D)(123)TRIAZOL5AMINE

2(3CHLORO4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(3CHLORO4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2(3CHLORO4METHOXYPHENYL)6METHYL2HYDROBENZOTRIAZOLE5YLAMINE

2(3CHLORO4METHOXYPHENYL)6METHYLBENZOTRIAZOL5AMINE

356085762

CC1=CC2=NN(N=C2C=C1N)C3=CC(=C(C=C3)OC)Cl

InChI=1SC14H13ClN4Oc1851213(711(8)16)1819(1712)93414(202)10(15)69h37H16H212H3


BBL000210
Synonyms: 2-(4-ethoxyphenyl)-6-methyl-2H-benzotriazol-5-amine
Smiles: CCOc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

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CCOc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

MFCD02615070

ZINC000000038189

ZINC00038189

ZINC38189

(6METHYL2PPHENETYLBENZOTRIAZOL5YL)AMINE

2(4ETHOXYPHENYL)6METHYL123BENZOTRIAZOL5AMINE

2(4ETHOXYPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4ETHOXYPHENYL)6METHYL2HBENZO(D)(123)TRIAZOL5AMINE

2(4ETHOXYPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4ETHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2(4ETHOXYPHENYL)6METHYL2HYDROBENZOTRIAZOLE5YLAMINE

2(4ETHOXYPHENYL)6METHYL5BENZOTRIAZOLAMINE

2(4ETHOXYPHENYL)6METHYLBENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4ETHOXYPHENYL)6METHYL

355818007

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C

InChI=1SC15H16N4Oc1320126411(5712)191714810(2)13(16)915(14)1819h49H316H212H3


BBL000211
Synonyms: [4-(4-aminophenyl)piperazin-1-yl](phenyl)methanone
Smiles: Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1

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Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1

PIPERAZINE1(4AMINOPHENYL)4BENZOYL

ZINC00276196

ZINC276196

(4(4AMINOPHENYL)PIPERAZIN1YL)(PHENYL)METHANONE

(4(4AMINOPHENYL)PIPERAZIN1YL)PHENYLMETHANONE

(4(4BENZOYLPIPERAZIN1YL)PHENYL)AMINE

262375995

C1CN(CCN1C2=CC=C(C=C2)N)C(=O)C3=CC=CC=C3

InChI=1SC17H19N3Oc18156816(9715)19101220(131119)17(21)144213514h19H101318H2


BBL000212
Synonyms: 2-(4-tert-butylphenyl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1ccc(cc1)C(C)(C)C

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Nc1ccc2c(c1)nc(o2)c1ccc(cc1)C(C)(C)C

ZINC000000125067

ZINC00125067

ZINC125067

MFCD00422785

2(4(TERTBUTYL)PHENYL)13BENZOXAZOL5AMINE

2(4(TERTBUTYL)PHENYL)BENZO(D)OXAZOL5AMINE

2(4(TERTBUTYL)PHENYL)BENZOXAZOLE5YLAMINE

2(4TERTBUTYLPHENYL)13BENZOXAZOL5AMINE

2(4TERTBUTYLPHENYL)BENZOOXAZOL5YLAMINE

2(4TERTBUTYLPHENYL)BENZOOXAZOLE5YLAMINE

293738213

5BENZOXAZOLAMINE2(4(11DIMETHYLETHYL)PHENYL)

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N

InChI=1SC17H18N2Oc117(23)126411(5712)1619141013(18)8915(14)2016h410H18H213H3


BBL000213
Synonyms: N-(4-amino-2-methylphenyl)benzamide
Smiles: Nc1ccc(c(c1)C)NC(=O)c1ccccc1

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Nc1ccc(c(c1)C)NC(=O)c1ccccc1

ZINC000000259730

ZINC00259730

ZINC259730

104478991

BENZAMIDEN(4AMINO2METHYLPHENYL)

MFCD01145119

N(4AMINO2METHYLPHENYL)BENZAMIDE

NBENZOYL2METHYL4AMINOANILINE

CC1=C(C=CC(=C1)N)NC(=O)C2=CC=CC=C2

InChI=1SC14H14N2Oc110912(15)7813(10)1614(17)115324611h29H15H21H3(H1617)


BBL000214
Synonyms: N-(4-aminophenyl)propanamide
Smiles: CCC(=O)Nc1ccc(cc1)N

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CCC(=O)Nc1ccc(cc1)N

4PROPIONYLAMINOANILINE

59690890

ACETAMIDEN(4AMINOPHENYL)NMETHYL

MFCD02063079

N(4AMINOPHENYL)PROPANAMIDE

N(4AMINOPHENYL)PROPIONAMIDE

PAMINOPROPIONANILIDE

ZINC000000123135

ZINC00123135

ZINC123135

CCC(=O)NC1=CC=C(C=C1)N

InChI=1SC9H12N2Oc129(12)118537(10)468h36H210H21H3(H1112)


BBL000215
Synonyms: N-(4-aminophenyl)benzamide
Smiles: Nc1ccc(cc1)NC(=O)c1ccccc1

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Nc1ccc(cc1)NC(=O)c1ccccc1

PAMINOBENZANILIDE

ZINC000000123070

ZINC00123070

ZINC123070

17625831

44DIAMINOBENZOYLANILIDE

4AMINOBENZANILIDE

BENZAMIDEN(4AMINOPHENYL)

MFCD00035777

N(4AMINOPHENYL)BENZAMIDE

NBENZOYL4AMINOANILINE

NBENZOYLPPHENYLENEDIAMINE

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N

InChI=1SC13H12N2Oc14116812(9711)1513(16)104213510h19H14H2(H1516)


BBL000216
Synonyms: 1,2-dihydroacenaphthylen-5-amine
Smiles: Nc1ccc2c3c1cccc3CC2

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Nc1ccc2c3c1cccc3CC2

ZINC01628332

ZINC1628332

12DIHYDRO5ACENAPHTHYLENAMINE

12DIHYDROACENAPHTHYLEN5AMINE

4657936

5ACENAPHTHENAMINE

5ACENAPHTHENEAMINE

5ACENAPHTHYLAMINE

5ACENAPHTHYLENAMINE12DIHYDRO

5ACENAPHTHYLENAMINE12DIHYDRO(9CI)

5ACENAPHTHYLENAMINE2DIHYDRO

5AMINO12DIHYDROACENAPHTHYLENE

5AMINOACENAPHTHENE

ACENAPHTHEN5AMINE

ACENAPHTHEN5YLAMINE

ACENAPHTHENE5YLAMINE

C1CC2=CC=CC3=C(C=CC1=C23)N

InChI=1SC12H11Nc131176954821310(11)12(8)9h1367H4513H2


BBL000217
Synonyms: 9H-fluoren-2-amine
Smiles: Nc1ccc2c(c1)Cc1c2cccc1

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Nc1ccc2c(c1)Cc1c2cccc1

ZINC01516303

ZINC1516303

FLUOREN2AMINE

FLUOREN2YLAMINE

FLUORENE2AMINO

FLUORENE2YLAMINE

(9HFLUORENE2AMINE)NRADICALANION

153786

2AMINOFLUORENE

2AMINOFLURENE

2FLUORENAMINE

2FLUORENEAMINE

2FLUORENYLAMINE

2FLUROENYLAMINE

9HFLUOREN2AMINE

9HFLUOREN2YLAMINE

AMINOFLUOREN

C1C2=CC=CC=C2C3=C1C=C(C=C3)N

InChI=1SC13H11Nc1411561310(811)79312412(9)13h168H714H2


BBL000218
Synonyms: 2-(3-bromophenyl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1cccc(c1)Br

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Nc1ccc2c(c1)nc(o2)c1cccc(c1)Br

ZINC000000123023

ZINC00123023

ZINC123023

MFCD00445929

(2(3BROMOPHENYL)13BENZOXAZOL5YL)AMINE

2(3BROMOPHENYL)13BENZOXAZOL5AMINE

2(3BROMOPHENYL)13BENZOXAZOL5AMINE95

2(3BROMOPHENYL)BENZO(D)OXAZOL5AMINE

2(3BROMOPHENYL)BENZOOXAZOL5YLAMINE

2(3BROMOPHENYL)BENZOXAZOLE5YLAMINE

293737812

5BENZOXAZOLAMINE2(3BROMOPHENYL)

C1=CC(=CC(=C1)Br)C2=NC3=C(O2)C=CC(=C3)N

InChI=1SC13H9BrN2Oc1493128(69)131611710(15)4512(11)1713h17H15H2


BBL000219
Synonyms: 4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)aniline
Smiles: Cc1ccc2c(c1)oc(n2)c1cc(N)ccc1Cl

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Cc1ccc2c(c1)oc(n2)c1cc(N)ccc1Cl

293737710

4CHLORO3(6METHYL13BENZOXAZOL2YL)ANILINE

4CHLORO3(6METHYLBENZO(D)OXAZOL2YL)ANILINE

4CHLORO3(6METHYLBENZOOXAZOL2YL)PHENYLAMINE

4CHLORO3(6METHYLBENZOXAZOL2YL)PHENYLAMINE

MFCD00442253

ZINC000000122984

ZINC00122984

ZINC122984

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)N)Cl

InChI=1SC14H11ClN2Oc18251213(68)1814(1712)1079(16)3411(10)15h27H16H21H3


BBL000220
Synonyms: 5-amino-2-(5-methyl-1,3-benzoxazol-2-yl)phenol
Smiles: Nc1ccc(c(c1)O)c1nc2c(o1)ccc(c2)C

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Nc1ccc(c(c1)O)c1nc2c(o1)ccc(c2)C

5amino2(5methyl13benzoxazol2yl)phenol

MFCD00440139

ZINC000000123090

293737914


BBL000221
Synonyms: 2-(4-methylphenyl)-1,3-benzoxazol-5-amine
Smiles: Cc1ccc(cc1)c1nc2c(o1)ccc(c2)N

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Cc1ccc(cc1)c1nc2c(o1)ccc(c2)N

MFCD00477461

ZINC000000125064

ZINC00125064

ZINC125064

(2(PTOLYL)13BENZOXAZOL5YL)AMINE

2(4METHYLPHENYL)13BENZOXAZOL5AMINE

2(4METHYLPHENYL)BENZOXAZOLE5YLAMINE

2PTOLYLBENZO(D)OXAZOL5AMINE

2PTOLYLBENZOOXAZOL5YLAMINE

2PTOLYLBENZOOXAZOLE5YLAMINE

54995505

5BENZOXAZOLAMINE2(4METHYLPHENYL)

CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N

InChI=1SC14H12N2Oc192410(539)141612811(15)6713(12)1714h28H15H21H3


BBL000222
Synonyms: N-(3-aminophenyl)butanamide
Smiles: CCCC(=O)Nc1cccc(c1)N

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CCCC(=O)Nc1cccc(c1)N

93469295

BUTANAMIDEN(3AMINOPHENYL)

MBUTYRYLAMINOANILINE

MFCD02063078

N(3AMINOPHENYL)BUTANAMIDE

N(3AMINOPHENYL)BUTYRAMIDE

ZINC000000123132

ZINC00123132

ZINC123132

CCCC(=O)NC1=CC=CC(=C1)N

InChI=1SC10H14N2Oc12410(13)1296358(11)79h357H2411H21H3(H1213)


BBL000223
Synonyms: 4-amino-2-(5-chloro-1,3-benzoxazol-2-yl)phenol
Smiles: Clc1ccc2c(c1)nc(o2)c1cc(N)ccc1O

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Clc1ccc2c(c1)nc(o2)c1cc(N)ccc1O

4amino2(5chloro13benzoxazol2yl)phenol

293737936

MFCD02063071

ZINC000000123096


BBL000224
Synonyms: 2-[4-(diethylamino)phenyl]-6-methyl-2H-benzotriazol-5-amine
Smiles: CCN(c1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C)CC

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CCN(c1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C)CC

(4(5AMINO6METHYL(2HYDROBENZOTRIAZOL2YL))PHENYL)DIETHYLAMINE

2(4(DIETHYLAMINO)PHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4(DIETHYLAMINO)PHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4(DIETHYLAMINO)PHENYL)6METHYLBENZOTRIAZOL5AMINE

2(4DIETHYLAMINOPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2HBENZOTRIAZOL5AMINE2(4(DIETHYLAMINO)PHENYL)6METHYL

381208408

MFCD02258019

ZINC000000459758

ZINC00459758

ZINC459758

CCN(CC)C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C

InChI=1SC17H21N5c1421(52)136814(9713)2219161012(3)15(18)1117(16)2022h611H4518H213H3


BBL000225
Synonyms: 2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1ccc(c(c1)Cl)C

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Nc1ccc2c(c1)nc(o2)c1ccc(c(c1)Cl)C

ZINC000000178818

ZINC00178818

ZINC178818

2(3CHLORO4METHYLPHENYL)13BENZOXAZOL5AMINE

2(3CHLORO4METHYLPHENYL)BENZO(D)OXAZOL5AMINE

2(3CHLORO4METHYLPHENYL)BENZOOXAZOL5YLAMINE

429649923

5BENZOXAZOLAMINE2(3CHLORO4METHYLPHENYL)

MFCD02628418

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N)Cl

InChI=1SC14H11ClN2Oc18239(611(8)15)141712710(16)4513(12)1814h27H16H21H3


BBL000226
Synonyms: 2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-amine
Smiles: COc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

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COc1ccc(cc1)n1nc2c(n1)cc(c(c2)N)C

MFCD02216347

ZINC000000168854

ZINC00168854

ZINC168854

2(4METHOXYPHENYL)6METHYL123BENZOTRIAZOL5AMINE

2(4METHOXYPHENYL)6METHYL2H123BENZOTRIAZOL5AMINE

2(4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5AMINE

2(4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YLAMINE

2(4METHOXYPHENYL)6METHYL2HYDROBENZOTRIAZOLE5YLAMINE

2(4METHOXYPHENYL)6METHYL5BENZOTRIAZOLAMINE

2(4METHOXYPHENYL)6METHYLBENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4METHOXYPHENYL)6METHYL

380560510

CC1=CC2=NN(N=C2C=C1N)C3=CC=C(C=C3)OC

InChI=1SC14H14N4Oc1971314(812(9)15)1718(1613)103511(192)6410h38H15H212H3


BBL000227
Synonyms: 2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)aniline
Smiles: Nc1cccc(c1C)c1nc2c(o1)cccn2

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Nc1cccc(c1C)c1nc2c(o1)cccn2

ZINC00266879

ZINC266879

2METHYL3((13)OXAZOLO(45B)PYRIDIN2YL)ANILINE

2METHYL3OXAZOLO(45B)PYRIDIN2YLPHENYLAMINE

328907886

BENZENAMINE2METHYL3OXAZOLO(45B)PYRIDIN2YL

CC1=C(C=CC=C1N)C2=NC3=C(O2)C=CC=N3

InChI=1SC13H11N3Oc189(42510(8)14)13161211(1713)6371512h27H14H21H3


BBL000228
Synonyms: 5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylaniline
Smiles: CCc1ccc2c(c1)nc(o2)c1ccc(c(c1)N)C

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CCc1ccc2c(c1)nc(o2)c1ccc(c(c1)N)C

292058550

5(5ETHYL13BENZOXAZOL2YL)2METHYLANILINE

5(5ETHYLBENZO(D)OXAZOL2YL)2METHYLANILINE

5(5ETHYLBENZOOXAZOL2YL)2METHYLPHENYLAMINE

5(5ETHYLBENZOXAZOL2YL)2METHYLPHENYLAMINE

BENZENAMINE5(5ETHYL2BENZOXAZOLYL)2METHYL

MFCD01114830

ZINC000000262404

ZINC00262404

ZINC262404

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)N

InChI=1SC16H16N2Oc1311571514(811)1816(1915)126410(2)13(17)912h49H317H212H3


BBL000229
Synonyms: 4-(5-ethyl-1,3-benzoxazol-2-yl)aniline
Smiles: CCc1ccc2c(c1)nc(o2)c1ccc(cc1)N

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CCc1ccc2c(c1)nc(o2)c1ccc(cc1)N

(4(5ETHYL13BENZOXAZOL2YL)PHENYL)AMINE

328908027

4(5ETHYL13BENZOXAZOL2YL)ANILINE

4(5ETHYLBENZOOXAZOL2YL)PHENYLAMINE

4(5ETHYLBENZOXAZOL2YL)PHENYLAMINE

BENZENAMINE4(5ETHYL2BENZOXAZOLYL)

MFCD00849408

ZINC000000154609

ZINC00154609

ZINC154609

CCC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)N

InChI=1SC15H14N2Oc1210381413(910)1715(1814)114612(16)7511h39H216H21H3


BBL000230
Synonyms: 5-amino-2-methyl-1H-isoindole-1,3(2H)-dione
Smiles: Nc1ccc2c(c1)C(=O)N(C2=O)C

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Nc1ccc2c(c1)C(=O)N(C2=O)C

NMETHYL4AMINOPHTHALIMIDE

ZINC00135566

ZINC135566

1HISOINDOLE13(2H)DIONE4AMINO2METHYL

1HISOINDOLE13(2H)DIONE5AMINO2METHYL

2307008

4AMINONMETHYLPHTHALIMIDE

5AMINO2METHYL1HISOINDOLE13(2H)DIONE

5AMINO2METHYL23DIHYDRO1HISOINDOLE13DIONE

5AMINO2METHYLBENZO(C)AZOLIDINE13DIONE

5AMINO2METHYLBENZO(C)AZOLINE13DIONE

5AMINO2METHYLISOINDOLE13DIONE

5AMINO2METHYLISOINDOLINE13DIONE

5AZANYL2METHYLISOINDOLE13DIONE

CN1C(=O)C2=C(C1=O)C=C(C=C2)N

InChI=1SC9H8N2O2c1118(12)6325(10)47(6)9(11)13h24H10H21H3


BBL000231
Synonyms: 3-(5-methyl-1,3-benzoxazol-2-yl)aniline
Smiles: Cc1ccc2c(c1)nc(o2)c1cccc(c1)N

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Cc1ccc2c(c1)nc(o2)c1cccc(c1)N

MFCD00579064

ZINC000000122953

ZINC00122953

ZINC122953

(3(5METHYL13BENZOXAZOL2YL)PHENYL)AMINE

3(5METHYL13BENZOXAZOL2YL)ANILINE

3(5METHYLBENZO(D)OXAZOL2YL)ANILINE

3(5METHYLBENZOOXAZOL2YL)ANILINE

3(5METHYLBENZOOXAZOL2YL)PHENYLAMINE

3(5METHYLBENZOXAZOL2YL)PHENYLAMINE

7509651

BENZENAMINE3(5METHYL2BENZOXAZOLYL)

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)N

InChI=1SC14H12N2Oc19561312(79)1614(1713)1032411(15)810h28H15H21H3


BBL000232
Synonyms: 1-(1,3-benzodioxol-5-yl)-N-(3-methoxybenzyl)methanamine
Smiles: COc1cccc(c1)CNCc1ccc2c(c1)OCO2

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COc1cccc(c1)CNCc1ccc2c(c1)OCO2

(13BENZODIOXOL5YLMETHYL)(3METHOXYBENZYL)AMINE

(13BENZODIOXOL5YLMETHYL)(3METHOXYBENZYL)AMINE95

(2HBENZO(34D)13DIOXOLAN5YLMETHYL)((3METHOXYPHENYL)METHYL)AMINE

1(13BENZODIOXOL5YL)N(3METHOXYBENZYL)METHANAMINE

355816114

BENZO(13)DIOXOL5YLMETHYL(3METHOXYBENZYL)AMINE

MFCD01468780

N(13BENZODIOXOL5YLMETHYL)1(3METHOXYPHENYL)METHANAMINE

N(13BENZODIOXOL5YLMETHYL)N(3METHOXYBENZYL)AMINE

N(3METHOXYBENZYL)13BENZODIOXOLE5METHANAMINE

ZINC000000200703

ZINC200703

COC1=CC=CC(=C1)CNCC2=CC3=C(C=C2)OCO3

InChI=1SC16H17NO3c1181442312(714)9171013561516(813)20111915h2817H911H21H3


BBL000233
Synonyms: 2-chloro-N-[(4-nitrophenyl)carbamothioyl]benzamide
Smiles: S=C(NC(=O)c1ccccc1Cl)Nc1ccc(cc1)[N+](=O)[O-]

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S=C(NC(=O)c1ccccc1Cl)Nc1ccc(cc1)(N+)(=O)(O)

ZINC000005277897

ZINC05277897

ZINC5277897

1(2CHLOROBENZOYL)3(4NITROPHENYL)THIOUREA

144487310

2CHLORON((4NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE

MFCD00033996

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)(N+)(=O)(O))Cl

InChI=1SC14H10ClN3O3Sc1512421311(12)13(19)1714(22)1695710(869)18(20)21h18H(H216171922)


BBL000234
Synonyms: 2-(3,4-dimethoxyphenyl)acetohydrazide
Smiles: NNC(=O)Cc1ccc(c(c1)OC)OC

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NNC(=O)Cc1ccc(c(c1)OC)OC

ZINC000000100433

ZINC00100433

ZINC100433

HOMOVERATRICHYDRAZIDE

MFCD00051701

(34DIMETHOXYPHENYL)ACETICACIDHYDRAZIDE

2(34DIMETHOXYPHENYL)ACETICHYDRAZIDE

2(34DIMETHOXYPHENYL)ACETOHYDRAZIDE

2(34DIMETHOXYPHENYL)ETHANEHYDRAZIDE

34DIMETHOXYPHENYLACETHYDRAZIDE

34DIMETHOXYPHENYLACETICACIDHYDRAZIDE

34DIMETHOXYPHENYLACETICHYDRAZIDE

60075232

BENZENEACETICACID34DIMETHOXYHYDRAZIDE

COC1=C(C=C(C=C1)CC(=O)NN)OC

InChI=1SC10H14N2O3c1148437(59(8)152)610(13)1211h35H611H212H3(H1213)


BBL000235
Synonyms: N-(3-aminophenyl)-3-chlorobenzamide
Smiles: Nc1cccc(c1)NC(=O)c1cccc(c1)Cl

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Nc1cccc(c1)NC(=O)c1cccc(c1)Cl

ZINC000000123078

ZINC00123078

ZINC123078

293737890

BENZAMIDEN(3AMINOPHENYL)3CHLORO

MFCD00443352

N(3AMINOPHENYL)(3CHLOROPHENYL)CARBOXAMIDE

N(3AMINOPHENYL)3CHLOROBENZAMIDE

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC=CC(=C2)N

InChI=1SC13H11ClN2Oc14104139(710)13(17)161262511(15)812h18H15H2(H1617)


BBL000236
Synonyms: N-(4-amino-2-methoxyphenyl)-1-benzofuran-2-carboxamide
Smiles: COc1cc(N)ccc1NC(=O)c1cc2c(o1)cccc2

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COc1cc(N)ccc1NC(=O)c1cc2c(o1)cccc2

2BENZOFURANCARBOXAMIDEN(4AMINO2METHOXYPHENYL)

335210032

BENZOFURAN2CARBOXYLICACID(4AMINO2METHOXYPHENYL)AMIDE

MFCD02258029

N(4AMINO2METHOXYPHENYL)1BENZOFURAN2CARBOXAMIDE

N(4AMINO2METHOXYPHENYL)BENZO(D)FURAN2YLCARBOXAMIDE

N(4AMINO2METHOXYPHENYL)BENZOFURAN2CARBOXAMIDE

ZINC000000038191

ZINC00038191

ZINC38191

COC1=C(C=CC(=C1)N)NC(=O)C2=CC3=CC=CC=C3O2

InChI=1SC16H14N2O3c12014911(17)6712(14)1816(19)15810423513(10)2115h29H17H21H3(H1819)


BBL000237
Synonyms: N-(4-amino-2-methoxyphenyl)pentanamide
Smiles: CCCCC(=O)Nc1ccc(cc1OC)N

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CCCCC(=O)Nc1ccc(cc1OC)N

461656440

MFCD03258542

N(4AMINO2METHOXYPHENYL)PENTANAMIDE

PENTANAMIDEN(4AMINO2METHOXYPHENYL)

PENTANOICACID(4AMINO2METHOXYPHENYL)AMIDE

ZINC000002382207

ZINC02382207

ZINC2382207

CCCCC(=O)NC1=C(C=C(C=C1)N)OC

InChI=1SC12H18N2O2c134512(15)1410769(13)811(10)162h68H3513H212H3(H1415)


BBL000238
Synonyms: N-(3-aminophenyl)pentanamide
Smiles: CCCCC(=O)Nc1cccc(c1)N

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CCCCC(=O)Nc1cccc(c1)N

59683840

MAMINOVALERANILIDE

MFCD03256019

N(3AMINOPHENYL)PENTANAMIDE

PENTANAMIDEN(3AMINOPHENYL)

PENTANOICACID(3AMINOPHENYL)AMIDE

ZINC000005859633

ZINC05859633

ZINC5859633

CCCCC(=O)NC1=CC=CC(=C1)N

InChI=1SC11H16N2Oc123711(14)13106459(12)810h468H23712H21H3(H1314)


BBL000239
Synonyms: N-(4-amino-2-methoxyphenyl)-2-chlorobenzamide
Smiles: COc1cc(N)ccc1NC(=O)c1ccccc1Cl

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COc1cc(N)ccc1NC(=O)c1ccccc1Cl

436089188

BENZAMIDEN(4AMINO2METHOXYPHENYL)2CHLORO

MFCD02585686

N(4AMINO2METHOXYPHENYL)(2CHLOROPHENYL)CARBOXAMIDE

N(4AMINO2METHOXYPHENYL)2CHLOROBENZAMIDE

ZINC000000570139

ZINC00570139

ZINC570139

COC1=C(C=CC(=C1)N)NC(=O)C2=CC=CC=C2Cl

InChI=1SC14H13ClN2O2c1191389(16)6712(13)1714(18)10423511(10)15h28H16H21H3(H1718)


BBL000240
Synonyms: 2-(2-chloro-4,5-difluorophenyl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1cc(F)c(cc1Cl)F

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Nc1ccc2c(c1)nc(o2)c1cc(F)c(cc1Cl)F

ZINC00475015

ZINC475015

2(2CHLORO45DIFLUOROPHENYL)13BENZOXAZOL5AMINE

2(2CHLORO45DIFLUOROPHENYL)BENZOOXAZOL5YLAMINE

2(2CHLORO45DIFLUOROPHENYL)BENZOXAZOLE5YLAMINE

530121745

5BENZOXAZOLAMINE2(2CHLORO45DIFLUOROPHENYL)

C1=CC2=C(C=C1N)N=C(O2)C3=CC(=C(C=C3Cl)F)F

InChI=1SC13H7ClF2N2Oc148510(16)9(15)47(8)13181136(17)1212(11)1913h15H17H2


BBL000241
Synonyms: N-(4-aminophenyl)-2-chlorobenzamide
Smiles: Nc1ccc(cc1)NC(=O)c1ccccc1Cl

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Nc1ccc(cc1)NC(=O)c1ccccc1Cl

ZINC000000569972

ZINC00569972

ZINC569972

27831896

BENZAMIDEN(4AMINOPHENYL)2CHLORO

MFCD00992462

N(4AMINOPHENYL)2CHLOROBENZAMIDE

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)N)Cl

InChI=1SC13H11ClN2Oc1412421311(12)13(17)1610759(15)6810h18H15H2(H1617)


BBL000242
Synonyms: 4-chloro-N-[(4-nitrophenyl)carbamothioyl]benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)Cl)Nc1ccc(cc1)[N+](=O)[O-]

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S=C(NC(=O)c1ccc(cc1)Cl)Nc1ccc(cc1)(N+)(=O)(O)

ZINC000004662965

ZINC04662965

ZINC4662965

1(4CHLOROBENZOYL)3(4NITROPHENYL)THIOUREA

108474824

4CHLORON((4NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE

MFCD02217811

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)(N+)(=O)(O))Cl

InChI=1SC14H10ClN3O3Sc1510319(2410)13(19)1714(22)16115712(8611)18(20)21h18H(H216171922)


BBL000243
Synonyms: 4-[5-(butan-2-yl)-1,3-benzoxazol-2-yl]aniline
Smiles: CCC(c1ccc2c(c1)nc(o2)c1ccc(cc1)N)C

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CCC(c1ccc2c(c1)nc(o2)c1ccc(cc1)N)C

MFCD01828753

ZINC000000277377

ZINC000000277380

4(5(BUTAN2YL)13BENZOXAZOL2YL)ANILINE

4(5(METHYLPROPYL)BENZOXAZOL2YL)PHENYLAMINE

4(5BUTAN2YL13BENZOXAZOL2YL)ANILINE

4(5SECBUTYLBENZOOXAZOL2YL)PHENYLAMINE

423150861

BENZENAMINE4(5(1METHYLPROPYL)2BENZOXAZOLYL)

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)N

InChI=1SC17H18N2Oc1311(2)13691615(1013)1917(2016)124714(18)8512h411H318H212H3


BBL000244
Synonyms: N-(3-aminophenyl)-2,4-dichlorobenzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1cccc(c1)N

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Clc1ccc(c(c1)Cl)C(=O)Nc1cccc(c1)N

293737925

BENZAMIDEN(3AMINOPHENYL)24DICHLORO

MFCD00852738

N(3AMINOPHENYL)(24DICHLOROPHENYL)CARBOXAMIDE

N(3AMINOPHENYL)24DICHLOROBENZAMIDE

ZINC000000123091

ZINC00123091

ZINC123091

C1=CC(=CC(=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl)N

InChI=1SC13H10Cl2N2Oc1484511(12(15)68)13(18)17103129(16)710h17H16H2(H1718)


BBL000245
Synonyms: N-(3-aminophenyl)-1-benzofuran-2-carboxamide
Smiles: Nc1cccc(c1)NC(=O)c1cc2c(o1)cccc2

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Nc1cccc(c1)NC(=O)c1cc2c(o1)cccc2

ZINC000000570138

ZINC00570138

ZINC570138

2BENZOFURANCARBOXAMIDEN(3AMINOPHENYL)

443292759

BENZO(B)FURAN2CARBOXYLICACID(3AMINOPHENYL)AMIDE

BENZOFURAN2CARBOXYLICACID(3AMINOPHENYL)AMIDE

MFCD03032340

N(3AMINOPHENYL)1BENZOFURAN2CARBOXAMIDE

N(3AMINOPHENYL)BENZO(D)FURAN2YLCARBOXAMIDE

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC=CC(=C3)N

InChI=1SC15H12N2O2c161153612(911)1715(18)14810412713(10)1914h19H16H2(H1718)


BBL000246
Synonyms: (2E)-3-(4-ethoxy-3-methoxyphenyl)prop-2-enoicacid
Smiles: CCOc1ccc(cc1OC)/C=C/C(=O)O

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CCOc1ccc(cc1OC)C=CC(=O)O

MFCD00016849

ZINC000000120487

ZINC120487

(2E)3(4ETHOXY3METHOXYPHENYL)ACRYLICACID

(2E)3(4ETHOXY3METHOXYPHENYL)PROP2ENOICACID

(E)3(3METHOXY4ETHOXYPHENYL)PROPENOICACID

(E)3(4ETHOXY3METHOXYPHENYL)ACRYLICACID

(E)3(4ETHOXY3METHOXYPHENYL)PROP2ENOICACID

4ETHOXY3METHOXYCINNAMICACID

58168813

CCOC1=C(C=C(C=C1)C=CC(=O)O)OC

InChI=1SC12H14O4c131610649(5712(13)14)811(10)152h48H3H212H3(H1314)b75+


BBL000247
Synonyms: 3-(1H-benzimidazol-2-yl)aniline
Smiles: Nc1cccc(c1)c1nc2c([nH]1)cccc2

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Nc1cccc(c1)c1nc2c((nH)1)cccc2

ZINC000000122913

ZINC00122913

ZINC122913

MFCD00600407

2(3AMINOPHENYL)1HBENZIMIDAZOLE

2(3AMINOPHENYL)BENZIMIDAZOLE

3(1H13BENZODIAZOL2YL)ANILINE

3(1HBENZIMIDAZOL2YL)ANILINE

3(1HBENZIMIDAZOL2YL)BENZENAMINE

3(1HBENZIMIDAZOL2YL)PHENYLAMINE

3(1HBENZO(D)IMIDAZOL2YL)ANILINE

3(1HBENZOIMIDAZOL2YL)PHENYLAMINE

3BENZIMIDAZOL2YLPHENYLAMINE

7596749

BENZENAMINE3(1HBENZIMIDAZOL2YL)

C1=CC=C2C(=C1)NC(=N2)C3=CC(=CC=C3)N

InChI=1SC13H11N3c14105349(810)131511612712(11)1613h18H14H2(H1516)


BBL000248
Synonyms: 3-(1,3-benzothiazol-2-yl)aniline
Smiles: Nc1cccc(c1)c1nc2c(s1)cccc2

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Nc1cccc(c1)c1nc2c(s1)cccc2

ZINC000000122909

ZINC00122909

ZINC122909

MFCD00579111

(3(13BENZOTHIAZOL2YL)PHENYL)AMINE

3(13BENZOTHIAZOL2YL)ANILINE

3(BENZOTHIAZOL2YL)ANILINE

3BENZOTHIAZOL2YLPHENYLAMINE

41230211

BENZENAMINE3(2BENZOTHIAZOLYL)

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)N

InChI=1SC13H10N2Sc14105349(810)131511612712(11)1613h18H14H2


BBL000249
Synonyms: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)C)sc2c1CCCC2

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N#Cc1c(NC(=O)C)sc2c1CCCC2

N(3cyano4567tetrahydro1benzothiophen2yl)acetamide

ZINC00040374

ZINC40374

20036979

CC(=O)NC1=C(C2=C(S1)CCCC2)C#N

InChI=1SC11H12N2OSc17(14)13119(612)8423510(8)1511h25H21H3(H1314)


BBL000250
Synonyms: 2-(4-methylphenyl)-1H-benzimidazole
Smiles: Cc1ccc(cc1)c1nc2c([nH]1)cccc2

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Cc1ccc(cc1)c1nc2c((nH)1)cccc2

MFCD00209485

ZINC000000133615

ZINC00133615

ZINC133615

120036

1HBENZIMIDAZOLE2(4METHYLPHENYL)

2(4METHYLPHENYL)1HBENZIMIDAZOLE

2(4METHYLPHENYL)1HBENZO(D)IMIDAZOLE

2(4METHYLPHENYL)BENZIMIDAZOLE

2(PTOLYL)1HBENZO(D)IMIDAZOLE

2PTOLYL1HBENZOIMIDAZOLE

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2

InChI=1SC14H12N2c1106811(9710)141512423513(12)1614h29H1H3(H1516)


BBL000251
Synonyms: 4,7-dimethyl-1,3-benzothiazol-2-amine
Smiles: Nc1nc2c(s1)c(C)ccc2C

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Nc1nc2c(s1)c(C)ccc2C

ZINC02455741

ZINC2455741

2AMINO47DIMETHYLBENZOTHIAZOLE

2BENZOTHIAZOLAMINE47DIMETHYL

47DIMETHYL13BENZOTHIAZOL2AMINE

47DIMETHYLBENZO(D)THIAZOL2AMINE

47DIMETHYLBENZOTHIAZOL2YLAMINE

47DIMETHYLBENZOTHIAZOLE2YLAMINE

78584084

CC1=C2C(=C(C=C1)C)SC(=N2)N

InChI=1SC9H10N2Sc15346(2)87(5)119(10)128h34H12H3(H21011)


BBL000252
Synonyms: 5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylaniline
Smiles: Clc1ccc2c(c1)nc(o2)c1ccc(c(c1)N)C

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Clc1ccc2c(c1)nc(o2)c1ccc(c(c1)N)C

292058492

5(5CHLORO13BENZOXAZOL2YL)2METHYLANILINE

5(5CHLOROBENZOOXAZOL2YL)2METHYLPHENYLAMINE

5(5CHLOROBENZOXAZOL2YL)2METHYLPHENYLAMINE

BENZENAMINE5(5CHLORO2BENZOXAZOLYL)2METHYL

MFCD00656147

ZINC000000125055

ZINC00125055

ZINC125055

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)N

InChI=1SC14H11ClN2Oc18239(611(8)16)141712710(15)4513(12)1814h27H16H21H3


BBL000253
Synonyms: 3-(1,3-benzoxazol-2-yl)-2-methylaniline
Smiles: Nc1cccc(c1C)c1nc2c(o1)cccc2

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Nc1cccc(c1C)c1nc2c(o1)cccc2

ZINC000000178823

ZINC00178823

ZINC178823

3(13BENZOXAZOL2YL)2METHYLANILINE

313549870

3BENZOOXAZOL2YL2METHYLPHENYLAMINE

BENZENAMINE3(2BENZOXAZOLYL)2METHYL

MFCD00579125

CC1=C(C=CC=C1N)C2=NC3=CC=CC=C3O2

InChI=1SC14H12N2Oc1910(54611(9)15)141612723813(12)1714h28H15H21H3


BBL000254
Synonyms: 2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)aniline
Smiles: Cc1ccc2c(c1)nc(o2)c1ccc(c(c1)N)C

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Cc1ccc2c(c1)nc(o2)c1ccc(c(c1)N)C

293737743

2METHYL5(5METHYL13BENZOXAZOL2YL)ANILINE

2METHYL5(5METHYLBENZO(D)OXAZOL2YL)ANILINE

2METHYL5(5METHYLBENZOOXAZOL2YL)PHENYLAMINE

2METHYL5(5METHYLBENZOXAZOL2YL)PHENYLAMINE

BENZENAMINE2METHYL5(5METHYL2BENZOXAZOLYL)

MFCD00579065

ZINC000000122991

ZINC00122991

ZINC122991

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)N

InChI=1SC15H14N2Oc19361413(79)1715(1814)115410(2)12(16)811h38H16H212H3


BBL000255
Synonyms: N-(3-aminophenyl)-4-tert-butylbenzamide
Smiles: Nc1cccc(c1)NC(=O)c1ccc(cc1)C(C)(C)C

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Nc1cccc(c1)NC(=O)c1ccc(cc1)C(C)(C)C

ZINC000000344957

ZINC00344957

ZINC344957

330997096

BENZAMIDEN(3AMINOPHENYL)4(11DIMETHYLETHYL)

MFCD00607319

N(3AMINOPHENYL)(4(TERTBUTYL)PHENYL)CARBOXAMIDE

N(3AMINOPHENYL)4(TERTBUTYL)BENZAMIDE

N(3AMINOPHENYL)4TERTBUTYLBENZAMIDE

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N

InChI=1SC17H20N2Oc117(23)139712(81013)16(20)191564514(18)1115h411H18H213H3(H1920)


BBL000256
Synonyms: [4-(4-amino-2-chlorophenyl)piperazin-1-yl](thiophen-2-yl)methanone
Smiles: Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)c1cccs1

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Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)c1cccs1

PIPERAZINE1(4AMINO2CHLOROPHENYL)4(2THIENYLCARBONYL)

ZINC000000528394

ZINC00528394

ZINC528394

MFCD03650767

(3CHLORO4(4(2THIENYLCARBONYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)(THIOPHEN2YL)METHANONE

(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)THIOPHEN2YLMETHANONE

3CHLORO4(4(2THIENYLCARBONYL)1PIPERAZINYL)PHENYLAMINE

4(4AMINO2CHLOROPHENYL)PIPERAZINYL2THIENYLKETONE

690960624

C1CN(CCN1C2=C(C=C(C=C2)N)Cl)C(=O)C3=CC=CS3

InChI=1SC15H16ClN3OSc16121011(17)3413(12)185719(8618)15(20)142192114h14910H5817H2


BBL000257
Synonyms: 4,6-dibromo-2-(2-chlorophenyl)-1,3-benzoxazol-5-amine
Smiles: Clc1ccccc1c1oc2c(n1)c(Br)c(c(c2)Br)N

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Clc1ccccc1c1oc2c(n1)c(Br)c(c(c2)Br)N

46DIBROMO2(2CHLOROPHENYL)13BENZOXAZOL5AMINE

46DIBROMO2(2CHLOROPHENYL)BENZO(D)OXAZOL5AMINE

46DIBROMO2(2CHLOROPHENYL)BENZOOXAZOL5YLAMINE

46DIBROMO2BENZOOXAZOL5YLAMINE

531515794

5BENZOXAZOLAMINE46DIBROMO2(2CHLOROPHENYL)

MFCD03565517

ZINC000003882271

ZINC03882271

ZINC3882271

C1=CC=C(C(=C1)C2=NC3=C(C(=C(C=C3O2)Br)N)Br)Cl

InChI=1SC13H7Br2ClN2Oc1475912(10(15)11(7)17)1813(199)631248(6)16h15H17H2


BBL000258
Synonyms: N-(4-aminophenyl)furan-2-carboxamide
Smiles: Nc1ccc(cc1)NC(=O)c1ccco1

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Nc1ccc(cc1)NC(=O)c1ccco1

ZINC000000123101

ZINC00123101

ZINC123101

21838584

2FURANCARBOXAMIDEN(4AMINOPHENYL)

FURAN2CARBOXYLICACID(4AMINOPHENYL)AMIDE

MFCD01171822

N(4AMINOPHENYL)2FURAMIDE

N(4AMINOPHENYL)2FURYLCARBOXAMIDE

N(4AMINOPHENYL)FURAN2CARBOXAMIDE

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)N

InChI=1SC11H10N2O2c128359(648)1311(14)102171510h17H12H2(H1314)


BBL000259
Synonyms: [4-(4-aminophenyl)piperazin-1-yl](2-fluorophenyl)methanone
Smiles: Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1F

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Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1F

PIPERAZINE1(4AMINOPHENYL)4(2FLUOROBENZOYL)

ZINC04386893

ZINC4386893

(4(4(2FLUOROBENZOYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINOPHENYL)PIPERAZIN1YL)(2FLUOROPHENYL)METHANONE

4(4(2FLUOROBENZOYL)1PIPERAZINYL)PHENYLAMINE

4(4(2FLUOROBENZOYL)PIPERAZIN1YL)ANILINE

4(4AMINOPHENYL)PIPERAZINYL2FLUOROPHENYLKETONE

758699842

C1CN(CCN1C2=CC=C(C=C2)N)C(=O)C3=CC=CC=C3F

InChI=1SC17H18FN3Oc1816421315(16)17(22)2111920(101221)147513(19)6814h18H91219H2


BBL000260
Synonyms: [4-(4-amino-2-chlorophenyl)piperazin-1-yl](furan-2-yl)methanone
Smiles: Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)c1ccco1

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Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)c1ccco1

PIPERAZINE1(4AMINO2CHLOROPHENYL)4(2FURANYLCARBONYL)

ZINC000001068127

ZINC01068127

ZINC1068127

(3CHLORO4(4(2FUROYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)(FURAN2YL)METHANONE

(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)FURAN2YLMETHANONE

3CHLORO4(4(2FUROYL)1PIPERAZINYL)PHENYLAMINE

757206874

MFCD05843334

C1CN(CCN1C2=C(C=C(C=C2)N)Cl)C(=O)C3=CC=CO3

InChI=1SC15H16ClN3O2c16121011(17)3413(12)185719(8618)15(20)142192114h14910H5817H2


BBL000261
Synonyms: 5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylaniline
Smiles: CCc1nnc2n1nc(s2)c1ccc(c(c1)N)C

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CCc1nnc2n1nc(s2)c1ccc(c(c1)N)C

ZINC02348126

ZINC2348126

5(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLANILINE

5(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYLAMINE

5(3ETHYL(124TRIAZOLO(34B)134THIADIAZOLIN6YL))2METHYLPHENYLAMINE

764710114

CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)N

InChI=1SC12H13N5Sc131014151217(10)1611(1812)8547(2)9(13)68h46H313H212H3


BBL000262
Synonyms: N-[4-({[(4-tert-butylphenyl)carbonyl]carbamothioyl}amino)-2-methoxyphenyl]-2-chlorobenzamide
Smiles: COc1cc(ccc1NC(=O)c1ccccc1Cl)NC(=S)NC(=O)c1ccc(cc1)C(C)(C)C

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COc1cc(ccc1NC(=O)c1ccccc1Cl)NC(=S)NC(=O)c1ccc(cc1)C(C)(C)C

462083494

MFCD03255179

N(4((((4TERTBUTYLPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)2METHOXYPHENYL)2CHLOROBENZAMIDE

N(4(((4TERTBUTYLBENZOYL)CARBAMOTHIOYL)AMINO)2METHOXYPHENYL)2CHLOROBENZAMIDE

N(4((4TERTBUTYLBENZOYL)CARBAMOTHIOYLAMINO)2METHOXYPHENYL)2CHLOROBENZAMIDE

ZINC000002812415

ZINC02812415

ZINC2812415

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)OC

InChI=1SC26H26ClN3O3Sc126(23)1711916(101217)23(31)3025(34)2818131421(22(1518)334)2924(32)19756820(19)27h515H14H3(H2932)(H228303134)


BBL000263
Synonyms: 1-(3,4-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)methanamine
Smiles: COc1cc(CNCc2ccncc2)ccc1OC

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COc1cc(CNCc2ccncc2)ccc1OC

((34DIMETHOXYPHENYL)METHYL)(4PYRIDYLMETHYL)AMINE

((34DIMETHOXYPHENYL)METHYL)(PYRIDIN4YLMETHYL)AMINE

(34DIMETHOXYBENZYL)PYRIDIN4YLMETHYLAMINE

1(34DIMETHOXYPHENYL)N(PYRIDIN4YLMETHYL)METHANAMINE

57342208

MFCD01135985

N((34DIMETHOXYPHENYL)METHYL)1PYRIDIN4YLMETHANAMINE

N(34DIMETHOXYBENZYL)1(PYRIDIN4YL)METHANAMINE

N(34DIMETHOXYBENZYL)N(PYRIDIN4YLMETHYL)AMINE

ZINC000000292794

ZINC292794

COC1=C(C=C(C=C1)CNCC2=CC=NC=C2)OC

InChI=1SC15H18N2O2c118144313(915(14)192)1117101257168612h3917H1011H212H3


BBL000264
Synonyms: N-(3-aminophenyl)-2-methylbenzamide
Smiles: Nc1cccc(c1)NC(=O)c1ccccc1C

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Nc1cccc(c1)NC(=O)c1ccccc1C

ZINC000000123112

ZINC00123112

ZINC123112

293737970

BENZAMIDEN(3AMINOPHENYL)2METHYL

MFCD00297696

N(3AMINOPHENYL)(2METHYLPHENYL)CARBOXAMIDE

N(3AMINOPHENYL)2METHYLBENZAMIDE

CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)N

InChI=1SC14H14N2Oc110523813(10)14(17)161274611(15)912h29H15H21H3(H1617)


BBL000265
Synonyms: 2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-amine
Smiles: COc1ccc(cc1Br)c1nc2c(o1)ccc(c2)N

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COc1ccc(cc1Br)c1nc2c(o1)ccc(c2)N

2(3BROMO4METHOXYPHENYL)13BENZOXAZOL5AMINE

2(3BROMO4METHOXYPHENYL)BENZO(D)OXAZOL5AMINE

2(3BROMO4METHOXYPHENYL)BENZOOXAZOL5YLAMINE

2(3BROMO4METHOXYPHENYL)BENZOXAZOLE5YLAMINE

293737889

5BENZOXAZOLAMINE2(3BROMO4METHOXYPHENYL)

MFCD00579054

ZINC000000123051

ZINC00123051

ZINC123051

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N)Br

InChI=1SC14H11BrN2O2c11812428(610(12)15)14171179(16)3513(11)1914h27H16H21H3


BBL000266
Synonyms: 2-(3-iodophenyl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1cccc(c1)I

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Nc1ccc2c(c1)nc(o2)c1cccc(c1)I

ZINC000000125057

ZINC00125057

ZINC125057

MFCD00477466

2(3IODOPHENYL)13BENZOXAZOL5AMINE

2(3IODOPHENYL)BENZO(D)OXAZOL5AMINE

2(3IODOPHENYL)BENZOOXAZOL5YLAMINE

2(3IODOPHENYL)BENZOXAZOLE5YLAMINE

54995572

5BENZOXAZOLAMINE2(3IODOPHENYL)

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)N

InChI=1SC13H9IN2Oc1493128(69)131611710(15)4512(11)1713h17H15H2


BBL000267
Synonyms: 2-(4-chlorophenyl)-2H-benzotriazol-5-amine
Smiles: Clc1ccc(cc1)n1nc2c(n1)ccc(c2)N

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Clc1ccc(cc1)n1nc2c(n1)ccc(c2)N

MFCD01933043

ZINC000000123094

ZINC00123094

ZINC123094

2(4CHLOROPHENYL)2H123BENZOTRIAZOL5AMINE

2(4CHLOROPHENYL)2HBENZO(123)TRIAZOL5YLAMINE

2(4CHLOROPHENYL)2HBENZO(D)(123)TRIAZOL5AMINE

2(4CHLOROPHENYL)2HBENZOTRIAZOL5AMINE

2(4CHLOROPHENYL)2HBENZOTRIAZOL5YLAMINE

2(4CHLOROPHENYL)2HYDROBENZOTRIAZOLE5YLAMINE

2(4CHLOROPHENYL)BENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(4CHLOROPHENYL)

40655092

C1=CC(=CC=C1N2N=C3C=CC(=CC3=N2)N)Cl

InChI=1SC12H9ClN4c1381410(528)171511639(14)712(11)1617h17H14H2


BBL000268
Synonyms: 2-(3-chloro-4-methylphenyl)-2H-benzotriazol-5-amine
Smiles: Nc1ccc2c(c1)nn(n2)c1ccc(c(c1)Cl)C

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Nc1ccc2c(c1)nn(n2)c1ccc(c(c1)Cl)C

ZINC000000570093

ZINC00570093

ZINC570093

MFCD01836728

(2(3CHLORO4METHYLPHENYL)BENZOTRIAZOL5YL)AMINE

2(3CHLORANYL4METHYLPHENYL)BENZOTRIAZOL5AMINE

2(3CHLORO4METHYLPHENYL)2H123BENZOTRIAZOL5AMINE

2(3CHLORO4METHYLPHENYL)2HBENZOTRIAZOL5AMINE

2(3CHLORO4METHYLPHENYL)2HBENZOTRIAZOL5YLAMINE

2(3CHLORO4METHYLPHENYL)5BENZOTRIAZOLAMINE

2(3CHLORO4METHYLPHENYL)BENZOTRIAZOL5AMINE

2HBENZOTRIAZOL5AMINE2(3CHLORO4METHYLPHENYL)

313402367

CC1=C(C=C(C=C1)N2N=C3C=CC(=CC3=N2)N)Cl

InChI=1SC13H11ClN4c182410(711(8)14)181612539(15)613(12)1718h27H15H21H3


BBL000269
Synonyms: [4-(4-aminophenyl)piperazin-1-yl](thiophen-2-yl)methanone
Smiles: Nc1ccc(cc1)N1CCN(CC1)C(=O)c1cccs1

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Nc1ccc(cc1)N1CCN(CC1)C(=O)c1cccs1

PIPERAZINE1(4AMINOPHENYL)4(2THIENYLCARBONYL)

ZINC00904309

ZINC904309

(4(4(2THIENYLCARBONYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINOPHENYL)1PIPERAZINYL)THIOPHEN2YLMETHANONE

(4(4AMINOPHENYL)PIPERAZIN1YL)(THIOPHEN2YL)METHANONE

(4(4AMINOPHENYL)PIPERAZIN1YL)THIOPHEN2YLMETHANONE

(4(4AMINOPHENYL)PIPERAZINO)(2THIENYL)METHANONE

4(4AMINOPHENYL)PIPERAZINYL2THIENYLKETONE

412331954

C1CN(CCN1C2=CC=C(C=C2)N)C(=O)C3=CC=CS3

InChI=1SC15H17N3OSc16123513(6412)177918(10817)15(19)1421112014h1611H71016H2


BBL000270
Synonyms: 6-methyl-2-phenyl-2H-benzotriazol-5-amine
Smiles: Nc1cc2nn(nc2cc1C)c1ccccc1

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Nc1cc2nn(nc2cc1C)c1ccccc1

ZINC000000156788

ZINC00156788

ZINC156788

MFCD01239296

123BENZOTRIAZOLE5AMINO6METHYL2PHENYL

2HBENZOTRIAZOL5AMINE6METHYL2PHENYL

6METHYL2PHENYL2H123BENZOTRIAZOL5YLAMINE

6METHYL2PHENYL2HBENZO(D)(123)TRIAZOL5AMINE

6METHYL2PHENYL2HBENZOTRIAZOL5AMINE

6METHYL2PHENYL2HBENZOTRIAZOL5YLAMINE

6METHYL2PHENYL2HYDROBENZOTRIAZOLE5YLAMINE

6METHYL2PHENYLBENZOTRIAZOL5AMINE

82811232

CC1=CC2=NN(N=C2C=C1N)C3=CC=CC=C3

InChI=1SC13H12N4c1971213(811(9)14)1617(1512)105324610h28H14H21H3


BBL000271
Synonyms: 4-chloro-3-(5-ethyl-1,3-benzoxazol-2-yl)aniline
Smiles: CCc1ccc2c(c1)nc(o2)c1cc(N)ccc1Cl

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CCc1ccc2c(c1)nc(o2)c1cc(N)ccc1Cl

MFCD01114831

ZINC000000172940

ZINC00172940

ZINC172940

(4CHLORO3(5ETHYL13BENZOXAZOL2YL)PHENYL)AMINE

426243369

4CHLORANYL3(5ETHYL13BENZOXAZOL2YL)ANILINE

4CHLORO3(5ETHYL13BENZOXAZOL2YL)ANILINE

4CHLORO3(5ETHYLBENZOOXAZOL2YL)PHENYLAMINE

4CHLORO3(5ETHYLBENZOXAZOL2YL)PHENYLAMINE

BENZENAMINE4CHLORO3(5ETHYL2BENZOXAZOLYL)

CCC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)N)Cl

InChI=1SC15H13ClN2Oc129361413(79)1815(1914)11810(17)4512(11)16h38H217H21H3


BBL000272
Synonyms: 4-[(2-methylpiperidin-1-yl)sulfonyl]aniline
Smiles: Nc1ccc(cc1)S(=O)(=O)N1CCCCC1C

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Nc1ccc(cc1)S(=O)(=O)N1CCCCC1C

109099696

4((2METHYLPIPERIDIN1YL)SULFONYL)ANILINE

4((2METHYLPIPERIDYL)SULFONYL)PHENYLAMINE

4(2METHYLPIPERIDIN1YL)SULFONYLANILINE

4(2METHYLPIPERIDIN1YLSULFONYL)ANILINE

4(2METHYLPIPERIDINE1SULFONYL)PHENYLAMINE

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)N

InChI=1SC12H18N2O2Sc110423914(10)17(1516)127511(13)6812h5810H24913H21H3


BBL000273
Synonyms: 4-(1,3-benzoxazol-2-yl)-2-methylaniline
Smiles: Nc1ccc(cc1C)c1nc2c(o1)cccc2

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Nc1ccc(cc1C)c1nc2c(o1)cccc2

ZINC000004413694

ZINC04413694

ZINC4413694

MFCD06666138

4(13BENZOXAZOL2YL)2METHYLANILINE

4(13BENZOXAZOL2YL)2METHYLANILINE95

4(13BENZOXAZOL2YL)2METHYLPHENYLAMINE

4(BENZO(D)OXAZOL2YL)2METHYLANILINE

4BENZOOXAZOL2YL2METHYLPHENYLAMINE

792946657

BENZENAMINE4(2BENZOXAZOLYL)2METHYL

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3O2)N

InChI=1SC14H12N2Oc19810(6711(9)15)141612423513(12)1714h28H15H21H3


BBL000274
Synonyms: ethyl5-amino-2-(morpholin-4-yl)benzoate
Smiles: CCOC(=O)c1cc(N)ccc1N1CCOCC1

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CCOC(=O)c1cc(N)ccc1N1CCOCC1

ETHYL5AMINO2(4MORPHOLINYL)BENZOATE

ETHYL5AMINO2(MORPHOLIN4YL)BENZOATE

ETHYL5AMINO2MORPHOLIN4YLBENZOATE

485388021

5AMINO2MORPHOLIN4YLBENZOICACIDETHYLESTER

BENZOICACID5AMINO2(4MORPHOLINYL)ETHYLESTER

MFCD06664472

ZINC000004386089

ZINC04386089

ZINC4386089

CCOC(=O)C1=C(C=CC(=C1)N)N2CCOCC2

InChI=1SC13H18N2O3c121813(16)11910(14)3412(11)1557178615h349H25814H21H3


BBL000275
Synonyms: 3-(3-amino-4-methylphenyl)-2H-chromen-2-one
Smiles: O=c1oc2ccccc2cc1c1ccc(c(c1)N)C

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O=c1oc2ccccc2cc1c1ccc(c(c1)N)C

ZINC000002204259

ZINC02204259

ZINC2204259

2H1BENZOPYRAN2ONE3(3AMINO4METHYLPHENYL)

3(3AMINO4METHYLPHENYL)2HCHROMEN2ONE

3(3AMINO4METHYLPHENYL)CHROMEN2ONE

766523766

MFCD05843345

CC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)N

InChI=1SC16H13NO2c1106711(914(10)17)13812423515(12)1916(13)18h29H17H21H3


BBL000276
Synonyms: 2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
Smiles: NCCSc1nnnn1C

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NCCSc1nnnn1C

ZINC000002643677

ZINC2643677

MFCD05134760

2((1METHYL1HTETRAZOL5YL)SULFANYL)ETHANAMINE

2((1METHYL1HTETRAZOL5YL)THIO)ETHANAMINE

2(1METHYL1HTETRAZOL5YLSULFANYL)ETHYLAMINE

2(1METHYLTETRAZOL5YL)SULFANYLETHANAMINE

774191081

CN1C(=NN=N1)SCCN

InChI=1SC4H9N5Sc194(6789)10325h235H21H3


BBL000277
Synonyms: [4-(4-aminophenyl)piperazin-1-yl](4-methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1)N

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Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1)N

PIPERAZINE1(4AMINOPHENYL)4(4METHYLBENZOYL)

ZINC00525957

ZINC525957

(4(4(4METHYLBENZOYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINOPHENYL)PIPERAZIN1YL)(4METHYLPHENYL)METHANONE

(4(4AMINOPHENYL)PIPERAZIN1YL)(PTOLYL)METHANONE

(4(4AMINOPHENYL)PIPERAZIN1YL)PTOLYLMETHANONE

262376012

4(4AMINOPHENYL)PIPERAZINYL4METHYLPHENYLKETONE

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)N

InChI=1SC18H21N3Oc1142415(5314)18(22)21121020(111321)178616(19)7917h29H101319H21H3


BBL000278
Synonyms: 4-(morpholin-4-yl)-3,5-dinitrobenzoicacid
Smiles: [O-][N+](=O)c1cc(cc(c1N1CCOCC1)[N+](=O)[O-])C(=O)O

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(O)(N+)(=O)c1cc(cc(c1N1CCOCC1)(N+)(=O)(O))C(=O)O

204634811

35DINITRO4MORPHOLINOBENZOICACID

4(MORPHOLIN4YL)35DINITROBENZOICACID

4MORPHOLIN4YL35DINITROBENZOICACID

4MORPHOLINO35DINITROBENZOICACID

MFCD00414784

ZINC000004499261

ZINC4499261

C1COCCN1C2=C(C=C(C=C2(N+)(=O)(O))C(=O)O)(N+)(=O)(O)

InChI=1SC11H11N3O7c1511(16)758(13(17)18)10(9(67)14(19)20)1213214212h56H14H2(H1516)


BBL000279
Synonyms: N-methyl-2-phenylpropan-1-amine
Smiles: CNCC(c1ccccc1)C

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CNCC(c1ccccc1)C

FENPROMETAMINA

1PHENYL1METHYL2METHYLAMINOAETHAN

93889

BENZENEETHANAMINENBETADIMETHYL(9CI)

METHYL(2PHENYLPROPYL)AMINE

METHYL(2PHENYLPROPYL)AMINEHYDROCHLORIDE

NMETHYL2PHENYL1PROPANAMINEHYDROCHLORIDE

NMETHYL2PHENYL1PROPYLAMINE

NMETHYL2PHENYLPROPAN1AMINE

NMETHYL2PHENYLPROPAN1AMINEHYDROCHLORIDE

PHENPROMETHADRINE

PHENPROMETHAMINE

PHENPROMETHAMINUM

CC(CNC)C1=CC=CC=C1

InChI=1SC10H15Nc19(8112)106435710h37911H8H212H3


BBL000280
Synonyms: N-(furan-2-ylmethyl)butan-1-amine
Smiles: CCCCNCc1ccco1

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CCCCNCc1ccco1

(2FURANYLMETHYL)BUTYLAMINE

2FURANMETHANAMINENBUTYL

88230539

BUTYL(FURAN2YLMETHYL)AMINE

MFCD01924418

N(2FURYLMETHYL)1BUTANAMINE

N(2FURYLMETHYL)BUTAN1AMINE

N(FURAN2YLMETHYL)BUTAN1AMINE

NBUTYLNFURFURYLAMINE

ZINC000001632729

ZINC1632729

CCCCNCC1=CC=CO1

InChI=1SC9H15NOc12361089547119h45710H2368H21H3


BBL000281
Synonyms: 2-[(chloroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: ClCC(=O)Nc1sc2c(c1C(=O)N)CCCC2

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ClCC(=O)Nc1sc2c(c1C(=O)N)CCCC2

2((chloroacetyl)amino)4567tetrahydro1benzothiophene3carboxamide

20886877

MFCD00226747

ZINC000000078181

ZINC00078181

ZINC78181

2((2chloroacetyl)amino)4567tetrahydro1benzothiophene3carboxamide

C1CCC2=C(C1)C(=C(S2)NC(=O)CCl)C(=O)N

InChI=1SC11H13ClN2O2Sc1258(15)14119(10(13)16)631247(6)1711h15H2(H21316)(H1415)


BBL000282
Synonyms: N-(2-methylpropyl)-3-phenylprop-2-yn-1-amine
Smiles: CC(CNCC#Cc1ccccc1)C

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CC(CNCC#Cc1ccccc1)C

2METHYLN(3PHENYLPROP2YNYL)PROPAN1AMINE

347406046

MFCD07405938

N(2METHYLPROPYL)3PHENYLPROP2YN1AMINE

N(3PHENYLPROPARGYL)ISOBUTYLAMINE

NISOBUTYL3PHENYL2PROPYN1AMINE

NISOBUTYL3PHENYLPROP2YN1AMINE

NISOBUTYLN(3PHENYL2PROPYNYL)AMINE

ZINC000006883510

ZINC6883510

CC(C)CNCC#CC1=CC=CC=C1

InChI=1SC13H17Nc112(2)11141069137435813h35781214H1011H212H3


BBL000283
Synonyms: 1-(pyridin-4-yl)-N-(pyridin-4-ylmethyl)methanamine
Smiles: N(Cc1ccncc1)Cc1ccncc1

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N(Cc1ccncc1)Cc1ccncc1

NNBIS(4PYRIDINYLMETHYL)AMINE

ZINC1506

N(4PYRIDINYLMETHYL)4PYRIDINEMETHANAMINE2HYDROXY123PROPANETRICARBOXYLATE

1(4PYRIDINYL)N(4PYRIDINYLMETHYL)METHANAMINE

1(PYRIDIN4YL)N(PYRIDIN4YLMETHYL)METHANAMINE

1539395

1PYRIDIN4YLN(PYRIDIN4YLMETHYL)METHANAMINE

4PYRIDINEMETHANAMINEN(4PYRIDINYLMETHYL)

BIS((PYRIDIN4YL)METHYL)AMINE

BIS(PYRIDIN4YLMETHYL)AMINE

C1=CN=CC=C1CNCC2=CC=NC=C2

InChI=1SC12H13N3c15136211(1)915101237148412h1815H910H2


BBL000284
Synonyms: 5-amino-2-(morpholin-4-yl)benzoicacid
Smiles: Nc1ccc(c(c1)C(=O)O)N1CCOCC1

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Nc1ccc(c(c1)C(=O)O)N1CCOCC1

ZINC000000319723

ZINC319723

MFCD01935677

5AMINO2(4MORPHOLINYL)BENZOICACID

5AMINO2(MORPHOLIN4YL)BENZOICACID

5AMINO2MORPHOLIN4YLBENZOICACID

5AMINO2MORPHOLINOBENZENECARBOXYLICACID

5AMINO2MORPHOLINOBENZOICACID

65989459

AMINOMORPHOLINOBENZENECARBOXYLICACID

BENZOICACID3AMINO6(4MORPHOLYL)

C1COCCN1C2=C(C=C(C=C2)N)C(=O)O

InChI=1SC11H14N2O3c1281210(9(78)11(14)15)1335166413h127H3612H2(H1415)


BBL000285
Synonyms: N-(3-chlorobenzyl)butan-1-amine
Smiles: CCCCNCc1cccc(c1)Cl

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CCCCNCc1cccc(c1)Cl

16183350

BENZENEMETHANAMINENBUTYL3CHLORO

BUTYL((3CHLOROPHENYL)METHYL)AMINE

BUTYL(3CHLOROBENZYL)AMINE

MFCD05740343

N((3CHLOROPHENYL)METHYL)BUTAN1AMINE

N(3CHLOROBENZYL)1BUTANAMINE

N(3CHLOROBENZYL)BUTAN1AMINE

NBUTYLN(3CHLOROBENZYL)AMINE

ZINC000002181869

ZINC2181869

CCCCNCC1=CC(=CC=C1)Cl

InChI=1SC11H16ClNc12371391054611(12)810h46813H2379H21H3


BBL000286
Synonyms: N-(thiophen-3-ylmethyl)butan-2-amine
Smiles: CCC(NCc1cscc1)C

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CCC(NCc1cscc1)C

892592868

MFCD07411606

N(3THIENYLMETHYL)2BUTANAMINE

N(THIOPHEN3YLMETHYL)BUTAN2AMINE

ZINC000007525009

ZINC000007525012

CCC(C)NCC1=CSC=C1

InChI=1SC9H15NSc138(2)1069451179h457810H36H212H3


BBL000287
Synonyms: 1-(pyridin-3-yl)-N-(thiophen-3-ylmethyl)methanamine
Smiles: c1ccc(cn1)CNCc1cscc1

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c1ccc(cn1)CNCc1cscc1

(3PYRIDYLMETHYL)(3THIENYLMETHYL)AMINE

(PYRIDIN3YLMETHYL)(3THIENYLMETHYL)AMINE

1(PYRIDIN3YL)N(THIOPHEN3YLMETHYL)METHANAMINE

1PYRIDIN3YLN(THIOPHEN3YLMETHYL)METHANAMINE

3PYRIDINEMETHANAMINEN(3THIENYLMETHYL)

892592608

MFCD07411595

N(3PYRIDINYLMETHYL)N(3THIENYLMETHYL)AMINE

ZINC000008419387

ZINC8419387

C1=CC(=CN=C1)CNCC2=CSC=C2

InChI=1SC11H12N2Sc1210(61241)7138113514911h16913H78H2


BBL000288
Synonyms: N-(pyridin-2-ylmethyl)butan-2-amine
Smiles: CCC(NCc1ccccn1)C

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CCC(NCc1ccccn1)C

58669311

MFCD07411572

N(2PYRIDINYLMETHYL)2BUTANAMINE

N(2PYRIDINYLMETHYL)2BUTANAMINE95

N(PYRIDIN2YLMETHYL)BUTAN2AMINE

ZINC000006870711

ZINC000006870776

CCC(C)NCC1=CC=CC=N1

InChI=1SC10H16N2c139(2)1281064571110h47912H38H212H3


BBL000289
Synonyms: 2-methyl-2-[(pyridin-2-ylmethyl)amino]propan-1-ol
Smiles: OCC(NCc1ccccn1)(C)C

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OCC(NCc1ccccn1)(C)C

ZINC000006858849

ZINC6858849

MFCD07411565

2METHYL2((2PYRIDINYLMETHYL)AMINO)1PROPANOL

2METHYL2((PYRIDIN2YLMETHYL)AMINO)PROPAN1OL

2METHYL2((PYRIDIN2YLMETHYL)AMINO)PROPAN1OL95

2METHYL2(PYRIDIN2YLMETHYLAMINO)PROPAN1OL

892591923

CC(C)(CO)NCC1=CC=CC=N1

InChI=1SC10H16N2Oc110(2813)12795346119h361213H78H212H3


BBL000290
Synonyms: 2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine
Smiles: CC(NCc1ccccn1)(C)C

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CC(NCc1ccccn1)(C)C

2(TERTBUTYLAMINOMETHYL)PYRIDINE

2METHYLN(2PYRIDINYLMETHYL)2PROPANAMINE

2METHYLN(2PYRIDINYLMETHYL)2PROPANAMINE95

2METHYLN(PYRIDIN2YLMETHYL)PROPAN2AMINE

58669322

N(TERTBUTYL)N(PYRIDIN2YLMETHYL)AMINE

NTERTBUTYLN(PYRIDIN2YLMETHYL)AMINE

TERTBUTYL(PYRIDIN2YLMETHYL)AMINE

ZINC6858815

CC(C)(C)NCC1=CC=CC=N1

InChI=1SC10H16N2c110(23)12896457119h4712H8H213H3


BBL000291
Synonyms: 5-(4-methoxy-2-nitrophenyl)furan-2-carboxylicacid
Smiles: COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)C(=O)O

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COc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C(=O)O

MFCD05843234

ZINC000004821130

ZINC4821130

2FURANCARBOXYLICACID5(4METHOXY2NITROPHENYL)

5(4METHOXY2NITROPHENYL)2FURANCARBOXYLICACID

5(4METHOXY2NITROPHENYL)2FUROICACID

5(4METHOXY2NITROPHENYL)FURAN2CARBOXYLICACID

95611908

COC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)O)(N+)(=O)(O)

InChI=1SC12H9NO6c1187238(9(67)13(16)17)104511(1910)12(14)15h26H1H3(H1415)


BBL000292
Synonyms: 2-[(2-methylbenzyl)amino]ethanol
Smiles: OCCNCc1ccccc1C

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OCCNCc1ccccc1C

ZINC000016362703

ZINC16362703

MFCD07410280

2((2METHYLBENZYL)AMINO)ETHANOL

2((2METHYLPHENYL)METHYLAMINO)ETHANOL

91251557

CC1=CC=CC=C1CNCCO

InChI=1SC10H15NOc19423510(9)8116712h251112H68H21H3


BBL000293
Synonyms: N-(2-methylbenzyl)propan-1-amine
Smiles: CCCNCc1ccccc1C

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CCCNCc1ccccc1C

(2METHYLBENZYL)PROPYLAMINE

807343028

MFCD07410290

N((2METHYLPHENYL)METHYL)PROPAN1AMINE

N(2METHYLBENZYL)NPROPYLAMINE

N(2METHYLBENZYL)PROPAN1AMINE

ZINC000007262410

ZINC7262410

CCCNCC1=CC=CC=C1C

InChI=1SC11H17Nc13812911754610(11)2h4712H389H212H3


BBL000294
Synonyms: N-(pyridin-2-ylmethyl)butan-1-amine
Smiles: CCCCNCc1ccccn1

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CCCCNCc1ccccn1

2PYRIDINEMETHANAMINENBUTYL

58061486

BUTYL(PYRIDIN2YLMETHYL)AMINE

MFCD07407937

N(2PYRIDINYLMETHYL)1

N(2PYRIDINYLMETHYL)1BUTANAMINE

N(PYRIDIN2YLMETHYL)BUTAN1AMINE

NBUTYL2PYRIDINEMETHANAMINE

NBUTYLPYRIDINE2METHYLAMINE

ZINC000005138960

ZINC5138960

CCCCNCC1=CC=CC=N1

InChI=1SC10H16N2c12371191064581210h46811H2379H21H3


BBL000295
Synonyms: N-(3-amino-4-methylphenyl)furan-2-carboxamide
Smiles: O=C(c1ccco1)Nc1ccc(c(c1)N)C

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O=C(c1ccco1)Nc1ccc(c(c1)N)C

ZINC000000410330

ZINC00410330

ZINC410330

436089291

FURAN2CARBOXYLICACID(3AMINO4METHYLPHENYL)AMIDE

MFCD02585705

N(3AMINO4METHYLPHENYL)2FURAMIDE

N(3AMINO4METHYLPHENYL)FURAN2CARBOXAMIDE

CC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)N

InChI=1SC12H12N2O2c18459(710(8)13)1412(15)113261611h27H13H21H3(H1415)


BBL000296
Synonyms: 2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1cc(Br)ccc1Cl

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Nc1ccc2c(c1)nc(o2)c1cc(Br)ccc1Cl

ZINC000000123045

ZINC00123045

ZINC123045

MFCD01145121

(2(5BROMO2CHLOROPHENYL)13BENZOXAZOL5YL)AMINE

13BENZOXAZOL5AMINE2(5BROMO2CHLOROPHENYL)

2(5BROMANYL2CHLORANYLPHENYL)13BENZOXAZOL5AMINE

2(5BROMO2CHLOROPHENYL)13BENZOXAZOL5AMINE

2(5BROMO2CHLOROPHENYL)BENZO(D)OXAZOL5AMINE

2(5BROMO2CHLOROPHENYL)BENZOOXAZOL5YLAMINE

2(5BROMO2CHLOROPHENYL)BENZOXAZOLE5YLAMINE

293737867

5BENZOXAZOLAMINE2(5BROMO2CHLOROPHENYL)

C1=CC2=C(C=C1N)N=C(O2)C3=C(C=CC(=C3)Br)Cl

InChI=1SC13H8BrClN2Oc1471310(15)9(57)13171168(16)2412(11)1813h16H16H2


BBL000297
Synonyms: 2-methoxy-N-(pyridin-3-ylmethyl)ethanamine
Smiles: COCCNCc1cccnc1

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COCCNCc1cccnc1

(2METHOXYETHYL)(3PYRIDINYLMETHYL)AMINE

(2METHOXYETHYL)(PYRIDIN3YLMETHYL)AMINE

(2METHOXYETHYL)PYRIDIN3YLMETHYLAMINE

120739686

2METHOXYN(PYRIDIN3YLMETHYL)ETHANAMINE

MFCD07408155

N(2METHOXYETHYL)N(3PYRIDYLMETHYL)AMINE

ZINC000007274776

ZINC7274776

COCCNCC1=CN=CC=C1

InChI=1SC9H14N2Oc1126511893241079h24711H568H21H3


BBL000298
Synonyms: 1-(2-methylphenyl)-N-(pyridin-4-ylmethyl)methanamine
Smiles: Cc1ccccc1CNCc1ccncc1

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Cc1ccccc1CNCc1ccncc1

MFCD06800991

N((2METHYLPHENYL)METHYL)1PYRIDIN4YLMETHANAMINE

N(2METHYLBENZYL)N(4PYRIDINYLMETHYL)AMINE

ZINC000004413634

ZINC4413634

((2METHYLPHENYL)METHYL)(PYRIDIN4YLMETHYL)AMINE

(2METHYLBENZYL)(4PYRIDINYLMETHYL)AMINEHYDROCHLORIDE

(2METHYLBENZYL)(PYRIDIN4YLMETHYL)AMINE

(2METHYLBENZYL)PYRIDIN4YLMETHYLAMINE

1(2METHYLPHENYL)N(PYRIDIN4YLMETHYL)METHANAMINE

880809541

AMINEHYDROCHLORIDE

CC1=CC=CC=C1CNCC2=CC=NC=C2

InChI=1SC14H16N2c112423514(12)1116101368159713h2916H1011H21H3


BBL000299
Synonyms: propyl5-amino-2-(morpholin-4-yl)benzoate
Smiles: CCCOC(=O)c1cc(N)ccc1N1CCOCC1

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CCCOC(=O)c1cc(N)ccc1N1CCOCC1

5AMINO2MORPHOLIN4YLBENZOICACIDPROPYLESTER

876892545

BENZOICACID5AMINO2(4MORPHOLINYL)PROPYLESTER

MFCD06752398

PROPYL5AMINO2(4MORPHOLINYL)BENZOATE

PROPYL5AMINO2(MORPHOLIN4YL)BENZOATE

PROPYL5AMINO2MORPHOLIN4YLBENZOATE

ZINC000004386090

ZINC04386090

ZINC4386090

CCCOC(=O)C1=C(C=CC(=C1)N)N2CCOCC2

InChI=1SC14H20N2O3c1271914(17)121011(15)3413(12)1658189616h3410H25915H21H3


BBL000300
Synonyms: 1-[4-(4-aminophenyl)piperazin-1-yl]-3-methylbutan-1-one
Smiles: CC(CC(=O)N1CCN(CC1)c1ccc(cc1)N)C

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CC(CC(=O)N1CCN(CC1)c1ccc(cc1)N)C

PIPERAZINE1(4AMINOPHENYL)4(3METHYL1OXOBUTYL)

ZINC06645476

ZINC6645476

(4(4(3METHYLBUTANOYL)PIPERAZIN1YL)PHENYL)AMINE

1(4(4AMINOPHENYL)PIPERAZIN1YL)3METHYLBUTAN1ONE

4(4(3METHYLBUTANOYL)1PIPERAZINYL)PHENYLAMINE

887833514

CC(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)N

InChI=1SC15H23N3Oc112(2)1115(19)189717(81018)145313(16)4614h3612H71116H212H3


BBL000301
Synonyms: 1-[4-(4-aminophenyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
Smiles: O=C(C(C)(C)C)N1CCN(CC1)c1ccc(cc1)N

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O=C(C(C)(C)C)N1CCN(CC1)c1ccc(cc1)N

PIPERAZINE1(4AMINOPHENYL)4(22DIMETHYL1OXOPROPYL)

ZINC06697539

ZINC6697539

(4(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)PHENYL)AMINE

1(4(4AMINOPHENYL)PIPERAZIN1YL)22DIMETHYLPROPAN1ONE

325168034

4(4(22DIMETHYLPROPANOYL)1PIPERAZINYL)ANILINE

CC(C)(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)N

InChI=1SC15H23N3Oc115(23)14(19)1810817(91118)136412(16)5713h47H81116H213H3


BBL000302
Synonyms: 6-(biphenyl-4-yl)-3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Cc1nnc2n1nc(s2)c1ccc(cc1)c1ccccc1

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Cc1nnc2n1nc(s2)c1ccc(cc1)c1ccccc1

193744104

3METHYL6(4PHENYLPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE

3METHYL6(BIPHENYL4YL)124TRIAZOLO(34B)(134)THIADIAZOLE

6(11BIPHENYL)4YL3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

6(BIPHENYL4YL)3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

6BIPHENYL4YL3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

MFCD06760483

ZINC000009190311

ZINC09190311

ZINC9190311

CC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI=1SC16H12N4Sc11117181620(11)1915(2116)149713(81014)125324612h210H1H3


BBL000303
Synonyms: 3-chloro-4-(pyrrolidin-1-yl)aniline
Smiles: Nc1ccc(c(c1)Cl)N1CCCC1

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Nc1ccc(c(c1)Cl)N1CCCC1

ZINC00783309

ZINC783309

16089444

3CHLORO4(1PYRROLIDINYL)ANILINE

3CHLORO4(PYRROLIDIN1YL)ANILINE

3CHLORO4PYRROLIDIN1YLANILINE

3CHLORO4PYRROLIDIN1YLPHENYLAMINE

3CHLORO4PYRROLIDINYLPHENYLAMINE

C1CCN(C1)C2=C(C=C(C=C2)N)Cl

InChI=1SC10H13ClN2c11978(12)3410(9)13512613h347H125612H2


BBL000304
Synonyms: N-(pyridin-3-ylmethyl)butan-1-amine
Smiles: CCCCNCc1cccnc1

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CCCCNCc1cccnc1

20173120

MFCD07409906

N(3PYRIDINYLMETHYL)1BUTANAMINE

N(3PYRIDINYLMETHYL)1BUTANEAMINE

N(PYRIDIN3YLMETHYL)BUTAN1AMINE

NBUTYL3PYRIDINEMETHANAMINE

ZINC000006868985

ZINC6868985

CCCCNCC1=CN=CC=C1

InChI=1SC10H16N2c12361181054712910h457911H2368H21H3


BBL000305
Synonyms: N-(4-ethoxybenzyl)cyclopropanamine
Smiles: CCOc1ccc(cc1)CNC1CC1

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CCOc1ccc(cc1)CNC1CC1

892571130

MFCD07408581

N((4ETHOXYPHENYL)METHYL)CYCLOPROPANAMINE

N(4ETHOXYBENZYL)CYCLOPROPANAMINE

N(4ETHOXYBENZYL)CYCLOPROPANAMINE95

NCYCLOPROPYLN(4ETHOXYBENZYL)AMINE

ZINC000008324062

ZINC8324062

CCOC1=CC=C(C=C1)CNC2CC2

InChI=1SC12H17NOc1214127310(4812)913115611h34781113H2569H21H3


BBL000306
Synonyms: N-(pyridin-3-ylmethyl)cycloheptanamine
Smiles: C1CCCC(CC1)NCc1cccnc1

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C1CCCC(CC1)NCc1cccnc1

179055426

MFCD07408153

N(3PYRIDINYLMETHYL)CYCLOHEPTANAMINE

N(3PYRIDINYLMETHYL)CYCLOHEPTANAMINEHYDROCHLORIDE

N(PYRIDIN3YLMETHYL)CYCLOHEPTANAMINE

ZINC000008419356

ZINC8419356

C1CCCC(CC1)NCC2=CN=CC=C2

InChI=1SC13H20N2c124813(731)151112659141012h569101315H147811H2


BBL000307
Synonyms: 2-methoxy-N-(2-methylbenzyl)ethanamine
Smiles: COCCNCc1ccccc1C

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COCCNCc1ccccc1C

MFCD07408107

ZINC000016362705

ZINC16362705

(2METHOXYETHYL)(2METHYLBENZYL)AMINE

2METHOXYN((2METHYLPHENYL)METHYL)ETHANAMINE

2METHOXYN(2METHYLBENZYL)ETHANAMINE

892565525

CC1=CC=CC=C1CNCCOC

InChI=1SC11H17NOc110534611(10)91278132h3612H79H212H3


BBL000308
Synonyms: 5-bromo-6-methylpyridin-2-amine
Smiles: Nc1ccc(c(n1)C)Br

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Nc1ccc(c(n1)C)Br

ZINC19015078

2AMINO5BROMO6METHYLPYRIDINE

2AMINO5BROMO6PICOLINE

2PYRIDINAMINE5BROMO6METHYL

3BROMO2METHYL6AMINOPYRIDINE

42753719

5BROMO2AMINO6PICOLINE

5BROMO6METHYL(PYRIDIN2YL)AMINE

5BROMO6METHYL2PYRIDINAMINE

5BROMO6METHYL2PYRIDYLAMINE

5BROMO6METHYLPYRIDIN2AMINE

5BROMO6METHYLPYRIDIN2YLAMINE

6AMINO3BROMO2METHYLPYRIDINE

6AMINO3BROMO2PICOLINE

6AMINO3BROMO2PICOLINE(6AMINO3BROMO2METHYLPYRIDINE)

CC1=C(C=CC(=N1)N)Br

InChI=1SC6H7BrN2c145(7)236(8)94h23H1H3(H289)


BBL000309
Synonyms: N-(4-methoxybenzyl)-1-phenylethanamine
Smiles: COc1ccc(cc1)CNC(c1ccccc1)C

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COc1ccc(cc1)CNC(c1ccccc1)C

((4METHOXYPHENYL)METHYL)(1PHENYLETHYL)AMINE

((4METHOXYPHENYL)METHYL)(PHENYLETHYL)AMINE

(4METHOXYBENZYL)(1PHENYLETHYL)AMINE

356537047

MFCD01475087

N((4METHOXYPHENYL)METHYL)1PHENYLETHANAMINE

N(4METHOXYBENZYL)1PHENYLETHANAMINE

N(4METHOXYBENZYL)ALPHAMETHYLBENZYLAMINE

N(4METHOXYBENZYL)N(1PHENYLETHYL)AMINE

N4METHOXYBENZYL1PHENYLETHYLAMINE

ZINC000000874260

ZINC000000874263

CC(C1=CC=CC=C1)NCC2=CC=C(C=C2)OC

InChI=1SC16H19NOc113(156435715)17121481016(182)11914h3111317H12H212H3


BBL000310
Synonyms: 4-amino-N-tert-butylbenzenesulfonamide
Smiles: CC(NS(=O)(=O)c1ccc(cc1)N)(C)C

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CC(NS(=O)(=O)c1ccc(cc1)N)(C)C

((4AMINOPHENYL)SULFONYL)(TERTBUTYL)AMINE

209917486

4AMINON(11DIMETHYLETHYL)BENZENESULFONAMIDE

4AMINON(TERTBUTYL)BENZENESULFONAMIDE

4AMINONTERTBUTYLBENZENESULFONAMIDE

MFCD03002128

N(11DIMETHYLETHYL)4AMINOBENZENESULFONAMIDE

NTBUTYL4AMINOPHENYLSULFONAMIDE

NTERTBUTYL4AMINOPHENYLSULFONAMIDE

ZINC000000357408

ZINC00357408

ZINC357408

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)N

InChI=1SC10H16N2O2Sc110(23)1215(1314)9648(11)579h4712H11H213H3


BBL000311
Synonyms: (2E)-3-(3-nitrophenyl)-1-phenylprop-2-en-1-one
Smiles: O=C(c1ccccc1)/C=C/c1cccc(c1)[N+](=O)[O-]

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O=C(c1ccccc1)C=Cc1cccc(c1)(N+)(=O)(O)

ZINC000004011827

ZINC04011827

ZINC4011827

CHALCONE3NITRO

MFCD00024571

MNITROBENZYLIDENEACETOPHENONE

(2E)3(3NITROPHENYL)1PHENYLPROP2EN1ONE

(E)3(3NITROPHENYL)1PHENYL2PROPEN1ONE

(E)3(3NITROPHENYL)1PHENYLPROP2EN1ONE

(E)3NITROCHALCONE

2PROPEN1ONE3(3NITROPHENYL)1PHENYL

2PROPEN1ONE3(3NITROPHENYL)1PHENYL(E)

3(3NITROPHENYL)1PHENYLPROPENONE

3NITROBENZYLIDENEACETOPHENONE

3NITROCHALCONE

614482

C1=CC=C(C=C1)C(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)

InChI=1SC15H11NO3c1715(136213713)1091254814(1112)16(18)19h111Hb109+


BBL000312
Synonyms: 5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methylaniline
Smiles: Nc1cc(ccc1C)c1oc2c(n1)cc(c(c2)C)C

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Nc1cc(ccc1C)c1oc2c(n1)cc(c(c2)C)C

ZINC000000266905

ZINC00266905

ZINC266905

292058538

5(56DIMETHYL13BENZOXAZOL2YL)2METHYLANILINE

5(56DIMETHYL13BENZOXAZOL2YL)2METHYLPHENYLAMINE

5(56DIMETHYLBENZOOXAZOL2YL)2METHYLPHENYLAMINE

BENZENAMINE5(56DIMETHYL2BENZOXAZOLYL)2METHYL

MFCD01593474

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=C(C(=C3)C)C)N

InChI=1SC16H16N2Oc194512(813(9)17)161814610(2)11(3)715(14)1916h48H17H213H3


BBL000313
Synonyms: 2-(4-tert-butylphenoxy)acetamide
Smiles: NC(=O)COc1ccc(cc1)C(C)(C)C

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NC(=O)COc1ccc(cc1)C(C)(C)C

ZINC03601604

ZINC3601604

2(4TERTBUTYLPHENOXY)ACETAMIDE

28329433

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N

InChI=1SC12H17NO2c112(23)94610(759)15811(13)14h47H8H213H3(H21314)


BBL000314
Synonyms: 4-amino-N-(2-phenylethyl)benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)NCCc1ccccc1

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Nc1ccc(cc1)S(=O)(=O)NCCc1ccccc1

SULFANILSAEUREPHENAETHYLAMID

ZINC000000359035

ZINC00359035

ZINC359035

((4AMINOPHENYL)SULFONYL)(2PHENYLETHYL)AMINE

4AMINON(2PHENYLETHYL)BENZENE1SULFONAMIDE

4AMINON(2PHENYLETHYL)BENZENESULFONAMIDE

4AMINONPHENETHYLBENZENESULFONAMIDE

587850677

MFCD03716650

N(2PHENYLETHYL)4AMINOBENZENESULFONAMIDE

C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)N

InChI=1SC14H16N2O2Sc15136814(9713)19(1718)161110124213512h1916H101115H2


BBL000315
Synonyms: 2-amino-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1ccccc1N)NCC1CCCO1

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O=C(c1ccccc1N)NCC1CCCO1

ZINC000000280693

ZINC000000280694

MFCD02032074

(2AMINOPHENYL)N(OXOLAN2YLMETHYL)CARBOXAMIDE

2AMINON((TETRAHYDROFURAN2YL)METHYL)BENZAMIDE

2AMINON(OXOLAN2YLMETHYL)BENZAMIDE

2AMINON(TETRAHYDRO2FURANYLMETHYL)BENZAMIDE

2AMINON(TETRAHYDROFURAN2YLMETHYL)BENZAMIDE

30646492

C1CC(OC1)CNC(=O)C2=CC=CC=C2N

InChI=1SC12H16N2O2c1311621510(11)12(15)1489437169h12569H347813H2(H1415)


BBL000316
Synonyms: N'-(2-methoxybenzyl)-N,N-dimethylbenzene-1,4-diamine
Smiles: COc1ccccc1CNc1ccc(cc1)N(C)C

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COc1ccccc1CNc1ccc(cc1)N(C)C

(4(((2METHOXYPHENYL)METHYL)AMINO)PHENYL)DIMETHYLAMINE

14BENZENEDIAMINEN4((2METHOXYPHENYL)METHYL)N1N1DIMETHYL

1N((2METHOXYPHENYL)METHYL)4N4NDIMETHYLBENZENE14DIAMINE

436088378

4N((2METHOXYPHENYL)METHYL)1N1NDIMETHYLBENZENE14DIAMINE

MFCD03044444

N(2METHOXYBENZYL)NNDIMETHYLBENZENE

N(2METHOXYBENZYL)NNDIMETHYLBENZENE14DIAMINE

N1(2METHOXYBENZYL)N4N4DIMETHYLBENZENE14DIAMINE

N4((2METHOXYPHENYL)METHYL)N1N1DIMETHYLBENZENE14DIAMINE

ZINC000000349813

ZINC00349813

ZINC349813

CN(C)C1=CC=C(C=C1)NCC2=CC=CC=C2OC

InChI=1SC16H20N2Oc118(2)1510814(91115)171213645716(13)193h41117H12H213H3


BBL000317
Synonyms: 3-(naphtho[1,2-d][1,3]oxazol-2-yl)aniline
Smiles: Nc1cccc(c1)c1oc2c(n1)c1ccccc1cc2

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Nc1cccc(c1)c1oc2c(n1)c1ccccc1cc2

ZINC000000558346

ZINC00558346

ZINC558346

3(NAPHTHO(12D)(13)OXAZOL2YL)ANILINE

3BENZO(E)(13)BENZOXAZOL2YLANILINE

3NAPHTHO(12D)OXAZOL2YLPHENYLAMINE

874999970

BENZENAMINE3NAPHTH(12D)OXAZOL2YL

MFCD01114799

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)C4=CC(=CC=C4)N

InChI=1SC17H12N2Oc181363512(1013)17191614721411(14)8915(16)2017h110H18H2


BBL000318
Synonyms: 3-[(E)-phenyldiazenyl]biphenyl-4-ol
Smiles: Oc1ccc(cc1/N=N/c1ccccc1)c1ccccc1

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Oc1ccc(cc1N=Nc1ccccc1)c1ccccc1

3((E)phenyldiazenyl)biphenyl4ol

63467447

MFCD01308877

ZINC000004990035


BBL000319
Synonyms: (benzylsulfanyl)aceticacid
Smiles: OC(=O)CSCc1ccccc1

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OC(=O)CSCc1ccccc1

SBENZYLMERCAPTOACETICACID

SBENZYLTHIOGLYCOLICACID

ZINC000000138404

ZINC138404

MFCD00004358

(BENZYLSULFANYL)ACETICACID

(BENZYLTHIO)ACETICACID

(SBENZYL)THIOGLYCOLICACID

103468

2(BENZYLSULFANYL)ACETICACID

2(BENZYLTHIO)ACETICACID

2(PHENYLMETHYLTHIO)ACETICACID

2BENZYLSULFANYLACETICACID

ACETICACID((PHENYLMETHYL)THIO)

ACETICACID(BENZYLTHIO)

ACETICACID(BENZYLTHIO)(8CI)

ACETICACID2((PHENYLMETHYL)THIO)

BENZYLMERCAPTOACETICACID

BENZYLSULFANYLACETICACID

C1=CC=C(C=C1)CSCC(=O)O

InChI=1SC9H10O2Sc109(11)71268421358h15H67H2(H1011)


BBL000320
Synonyms: N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)C

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COc1cccc(c1)NC(=O)C

3ACETAMIDOANISOL

3ACETAMIDOANISOLE

3METHOXYACETANILIDE

588169

ACETAMIDEN(3METHOXYPHENYL)

ACETANILIDE3METHOXY

ACETOMANISIDIDE

MACETANISIDIDE

MACETANISIDINE

MMETHOXYACETANILIDE

N(3METHOXYPHENYL)ACETAMIDE

N(3METHOXYPHENYL)ACETICACIDAMIDE

N(3METHOXYPHENYL)ETHANAMIDE

N1(3METHOXYPHENYL)ACETAMIDE

NACETYLMANISIDINE

ZINC00171655

ZINC171655

CC(=O)NC1=CC(=CC=C1)OC

InChI=1SC9H11NO2c17(11)1084359(68)122h36H12H3(H1011)


BBL000321
Synonyms: 5-(4-methyl-2-nitrophenyl)furan-2-carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(cc1[N+](=O)[O-])C

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O=Cc1ccc(o1)c1ccc(cc1(N+)(=O)(O))C

ZINC000000459585

ZINC00459585

ZINC459585

MFCD02221168

2FURANCARBOXALDEHYDE5(4METHYL2NITROPHENYL)

425645314

5(2NITRO4METHYLPHENYL)FURFURAL

5(4METHYL2NITROPHENYL)2FURALDEHYDE

5(4METHYL2NITROPHENYL)2FURANCARBOXALDEHYDE

5(4METHYL2NITROPHENYL)FURAN2CARBALDEHYDE

CC1=CC(=C(C=C1)C2=CC=C(O2)C=O)(N+)(=O)(O)

InChI=1SC12H9NO4c182410(11(68)13(15)16)12539(714)1712h27H1H3


BBL000322
Synonyms: 1-(benzyloxy)-4-nitrobenzene
Smiles: [O-][N+](=O)c1ccc(cc1)OCc1ccccc1

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(O)(N+)(=O)c1ccc(cc1)OCc1ccccc1

1(BENZYLOXY)4NITROBENZENE

1145762

1BENZYLOXY4NITROBENZENE

1NITRO4(PHENYLMETHOXY)BENZENE

1NITRO4PHENYLMETHOXYBENZENE

4BENZYLOXY1NITROBENZENE

4BENZYLOXYNITROBENZENE

4NITROPHENYLBENZYLETHER

BENZENE1NITRO4(PHENYLMETHOXY)

BENZYL4NITROPHENYLETHER

BENZYLPNITROPHENYLETHER

MFCD00024672

NITROBENZENE4(PHENYLMETHOXY)

P(BENZYLOXY)NITROBENZENE

ZINC000000091993

ZINC00091993

ZINC91993

ETHERBENZYLPNITROPHENYL

C1=CC=C(C=C1)COC2=CC=C(C=C2)(N+)(=O)(O)

InChI=1SC13H11NO3c1514(16)126813(9712)1710114213511h19H10H2


BBL000323
Synonyms: 2-hydroxy-5-nitrobenzaldehyde
Smiles: O=Cc1cc(ccc1O)[N+](=O)[O-]

more...



O=Cc1cc(ccc1O)(N+)(=O)(O)

SALICYLALDEHYDE5NITRO

SALICYLALDEHYDE5NITRO(6CI7CI8CI)

ZINC000049538688

ZINC49538688

MFCD00007337

2HYDROXY5NITROBENZALDEHYDE

2NITROSALICYLALDEHYDE

5NITRO2HYDROXYBENZALDEHYDE

5NITROSALICALDEHYDE

5NITROSALICLALDEHYDE

5NITROSALICYLALDEHDYE

5NITROSALICYLALDEHYDE

5NITROSOSALICYLALDEHYDE

97518

BENZALDEHYDE2HYDROXY5NITRO

C1=CC(=C(C=C1(N+)(=O)(O))C=O)O

InChI=1SC7H5NO4c94536(8(11)12)127(5)10h1410H


BBL000324
Synonyms: 5-bromo-2-chlorobenzamide
Smiles: Brc1ccc(c(c1)C(=O)N)Cl

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Brc1ccc(c(c1)C(=O)N)Cl

188774552

5BROMO2CHLOROBENZAMIDE

BENZAMIDE5BROMO2CHLORO

ZINC02566353

ZINC2566353

C1=CC(=C(C=C1Br)C(=O)N)Cl

InChI=1SC7H5BrClNOc84126(9)5(34)7(10)11h13H(H21011)


BBL000325
Synonyms: N-(4-amino-2-chlorophenyl)furan-2-carboxamide
Smiles: Nc1ccc(c(c1)Cl)NC(=O)c1ccco1

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Nc1ccc(c(c1)Cl)NC(=O)c1ccco1

ZINC000000123105

ZINC00123105

ZINC123105

293737958

FURAN2CARBOXYLICACID(4AMINO2CHLOROPHENYL)

FURAN2CARBOXYLICACID(4AMINO2CHLOROPHENYL)AMIDE

MFCD01114835

N(4AMINO2CHLOROPHENYL)2FURAMIDE

N(4AMINO2CHLOROPHENYL)2FURYLCARBOXAMIDE

N(4AMINO2CHLOROPHENYL)FURAN2CARBOXAMIDE

C1=COC(=C1)C(=O)NC2=C(C=C(C=C2)N)Cl

InChI=1SC11H9ClN2O2c12867(13)349(8)1411(15)102151610h16H13H2(H1415)


BBL000326
Synonyms: ethyl2-amino-1,3-benzothiazole-5-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)nc(s2)N

more...



CCOC(=O)c1ccc2c(c1)nc(s2)N

ETHYL2AMINO13BENZOTHIAZOLE5CARBOXYLATE

ETHYL2AMINOBENZOTHIAZOLE5CARBOXYLATE

103040922

2AMINOBENZOTHIAZOLE5CARBOXYLICACIDETHYLESTER

5BENZO(D)THIAZOLECARBOXYLICACID2AMINOETHYLESTER

5BENZOTHIAZOLECARBOXYLICACID2AMINOETHYLESTER

MFCD05664564

ZINC000000337928

ZINC00337928

ZINC337928

CCOC(=O)C1=CC2=C(C=C1)SC(=N2)N

InChI=1SC10H10N2O2Sc12149(13)63487(56)1210(11)158h35H2H21H3(H21112)


BBL000327
Synonyms: 3,5-dichloro-4-methoxy-N-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Smiles: COc1c(Cl)cc(cc1Cl)C(=O)Nc1ccc(cc1)c1nc2c(o1)cccn2

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COc1c(Cl)cc(cc1Cl)C(=O)Nc1ccc(cc1)c1nc2c(o1)cccn2

(35DICHLORO4METHOXYPHENYL)N(4(13OXAZOLO(45B)PYRIDIN2YL)PHENYL)CARBOXAMIDE

35DICHLORO4METHOXYN(4((13)OXAZOLO(45B)PYRIDIN2YL)PHENYL)BENZAMIDE

35DICHLORO4METHOXYN(4OXAZOLO(45B)PYRIDIN2YLPHENYL)BENZAMIDE

710284994

MFCD03992362

ZINC000001146425

ZINC01146425

ZINC1146425

COC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC=N4)Cl

InChI=1SC20H13Cl2N3O3c1271714(21)912(1015(17)22)19(26)24136411(5713)20251816(2820)3282318h210H1H3(H2426)


BBL000328
Synonyms: (2E)-1-[4-(2-amino-4-chlorophenyl)piperazin-1-yl]-3-phenylprop-2-en-1-one
Smiles: Clc1ccc(c(c1)N)N1CCN(CC1)C(=O)/C=C/c1ccccc1

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Clc1ccc(c(c1)N)N1CCN(CC1)C(=O)C=Cc1ccccc1

(2E)1(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)3PHENYLPROP2EN1ONE

(5CHLORO2(4CINNAMOYLPIPERAZIN1YL)PHENYL)AMINE

(E)1(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)3PHENYLPROP2EN1ONE

(E)1(4(2AMINO4CHLOROPHENYL)PIPERAZIN1YL)3PHENYLPROPENONE

5CHLORO2(4CINNAMOYL1PIPERAZINYL)PHENYLAMINE

879590279

MFCD07613589

ZINC000004733371

ZINC04733371

ZINC4733371

C1CN(CCN1C2=C(C=C(C=C2)Cl)N)C(=O)C=CC3=CC=CC=C3

InChI=1SC19H20ClN3Oc20167818(17(21)1416)22101223(131122)19(24)96154213515h1914H101321H2b96+


BBL000329
Synonyms: [4-(2-amino-6-chlorophenyl)piperazin-1-yl](4-methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1CCN(CC1)c1c(N)cccc1Cl

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Cc1ccc(cc1)C(=O)N1CCN(CC1)c1c(N)cccc1Cl

(3CHLORO2(4(4METHYLBENZOYL)PIPERAZIN1YL)PHENYL)AMINE

(4(2AMINO6CHLOROPHENYL)PIPERAZIN1YL)(4METHYLPHENYL)METHANONE

(4(2AMINO6CHLOROPHENYL)PIPERAZIN1YL)PTOLYLMETHANONE

3CHLORO2(4(4METHYLBENZOYL)1PIPERAZINYL)PHENYLAMINE

879590235

MFCD07613587

PIPERAZINE1(2AMINO6CHLOROPHENYL)4(4METHYLBENZOYL)

ZINC000004733365

ZINC04733365

ZINC4733365

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)N

InChI=1SC18H20ClN3Oc1135714(8613)18(23)2211921(101222)1715(19)32416(17)20h28H91220H21H3


BBL000330
Synonyms: propan-2-yl2-amino-1,3-benzothiazole-6-carboxylate
Smiles: CC(OC(=O)c1ccc2c(c1)sc(n2)N)C

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CC(OC(=O)c1ccc2c(c1)sc(n2)N)C

134949385

2AMINOBENZOTHIAZOLE6CARBOXYLICACIDISOPROPYLESTER

6BENZOTHIAZOLECARBOXYLICACID2AMINO1METHYLETHYLESTER

ISOPROPYL2AMINO13BENZOTHIAZOLE6CARBOXYLATE

METHYLETHYL2AMINOBENZOTHIAZOLE6CARBOXYLATE

MFCD03197458

PROPAN2YL2AMINO13BENZOTHIAZOLE6CARBOXYLATE

ZINC000003881161

ZINC03881161

ZINC3881161

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)N

InChI=1SC11H12N2O2Sc16(2)1510(14)73489(57)1611(12)138h36H12H3(H21213)


BBL000331
Synonyms: 4-amino-N-(4-methylphenyl)benzamide
Smiles: Cc1ccc(cc1)NC(=O)c1ccc(cc1)N

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Cc1ccc(cc1)NC(=O)c1ccc(cc1)N

(4AMINOPHENYL)N(4METHYLPHENYL)CARBOXAMIDE

4AMINON(4METHYLPHENYL)BENZAMIDE

4AMINON(PTOLYL)BENZAMIDE

955964

BENZAMIDE4AMINON(4METHYLPHENYL)

MFCD00447043

N(4METHYLPHENYL)4AMINOBENZAMIDE

ZINC000000225982

ZINC00225982

ZINC225982

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N

InChI=1SC14H14N2Oc1102813(9310)1614(17)114612(15)7511h29H15H21H3(H1617)


BBL000332
Synonyms: butyl2-amino-1,3-benzothiazole-6-carboxylate
Smiles: CCCCOC(=O)c1ccc2c(c1)sc(n2)N

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CCCCOC(=O)c1ccc2c(c1)sc(n2)N

134949396

2AMINOBENZOTHIAZOLE6CARBOXYLICACIDBUTYLESTER

6BENZOTHIAZOLECARBOXYLICACID2AMINOBUTYLESTER

BUTYL2AMINO13BENZOTHIAZOLE6CARBOXYLATE

MFCD08107280

ZINC000009192670

ZINC09192670

ZINC9192670

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)N

InChI=1SC12H14N2O2Sc12361611(15)845910(78)1712(13)149h457H236H21H3(H21314)


BBL000333
Synonyms: 2-amino-5-nitrobenzoicacid
Smiles: [O-][N+](=O)c1ccc(c(c1)C(=O)O)N

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(O)(N+)(=O)c1ccc(c(c1)C(=O)O)N

1AMINO2CARBOXY4NITROBENZENE

2AMINO5NITROBENZOICACID

2CARBOXY4NITROANILINE

5NITROANTHRANILICACID

616795

ANTHRANILICACID5NITRO

ANTHRANILICACID5NITRO(8CI)

BENZOICACID2AMINO5NITRO

MFCD00017039

ZINC000003878253

ZINC3878253

C1=CC(=C(C=C1(N+)(=O)(O))C(=O)O)N

InChI=1SC7H6N2O4c86214(9(12)13)35(6)7(10)11h13H8H2(H1011)


BBL000334
Synonyms: 1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
Smiles: Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)C(C)(C)C

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Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)C(C)(C)C

PIPERAZINE1(4AMINO2CHLOROPHENYL)4(22DIMETHYL1OXOPROPYL)

ZINC04387151

ZINC4387151

(3CHLORO4(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)PHENYL)AMINE

1(4(4AMINO2CHLOROPHENYL)PIPERAZIN1YL)22DIMETHYLPROPAN1ONE

3CHLORO4(4(22DIMETHYLPROPANOYL)1PIPERAZINYL)PHENYLAMINE

878441215

CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)N)Cl

InChI=1SC15H22ClN3Oc115(23)14(20)198618(7919)135411(17)1012(13)16h4510H6917H213H3


BBL000335
Synonyms: 5-{[(2-methoxyethyl)amino]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Smiles: COCCNCc1ccc2c(c1)n(C)c(=O)n2C

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COCCNCc1ccc2c(c1)n(C)c(=O)n2C

MFCD07434419

ZINC000006678564

ZINC6678564

5(((2METHOXYETHYL)AMINO)METHYL)13DIMETHYL13BENZODIAZOL2ONE

5(((2METHOXYETHYL)AMINO)METHYL)13DIMETHYL13DIHYDRO2HBENZIMIDAZOL2ONE

5(((2METHOXYETHYL)AMINO)METHYL)13DIMETHYL3HYDROBENZIMIDAZOL2ONE

5((2METHOXYETHYLAMINO)METHYL)13DIMETHYL13DIHYDROBENZOIMIDAZOL2ONE

5((2METHOXYETHYLAMINO)METHYL)13DIMETHYLBENZIMIDAZOL2ONE

878452972

CN1C2=C(C=C(C=C2)CNCCOC)N(C1=O)C

InChI=1SC13H19N3O2c115115410(91467183)812(11)16(2)13(15)17h45814H679H213H3


BBL000336
Synonyms: 1,3-dimethyl-5-[(prop-2-en-1-ylamino)methyl]-1,3-dihydro-2H-benzimidazol-2-one
Smiles: C=CCNCc1ccc2c(c1)n(C)c(=O)n2C

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C=CCNCc1ccc2c(c1)n(C)c(=O)n2C

MFCD07434404

ZINC000006678560

ZINC6678560

1050208633

13DIMETHYL5((PROP2EN1YLAMINO)METHYL)13BENZODIAZOL2ONE

13DIMETHYL5((PROP2EN1YLAMINO)METHYL)13DIHYDRO2HBENZIMIDAZOL2ONE

13DIMETHYL5((PROP2ENYLAMINO)METHYL)3HYDROBENZIMIDAZOL2ONE

13DIMETHYL5((PROP2ENYLAMINO)METHYL)BENZIMIDAZOL2ONE

5ALLYLAMINOMETHYL13DIMETHYL13DIHYDROBENZOIMIDAZOL2ONE

CN1C2=C(C=C(C=C2)CNCC=C)N(C1=O)C

InChI=1SC13H17N3Oc14714910561112(810)16(3)13(17)15(11)2h46814H179H223H3


BBL000337
Synonyms: (2E)-1-[4-(4-aminophenyl)piperazin-1-yl]-3-phenylprop-2-en-1-one
Smiles: Nc1ccc(cc1)N1CCN(CC1)C(=O)/C=C/c1ccccc1

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Nc1ccc(cc1)N1CCN(CC1)C(=O)C=Cc1ccccc1

ZINC000011569774

ZINC11569774

(2E)1(4(4AMINOPHENYL)PIPERAZIN1YL)3PHENYLPROP2EN1ONE

(4(4CINNAMOYLPIPERAZIN1YL)PHENYL)AMINE

(E)1(4(4AMINOPHENYL)PIPERAZIN1YL)3PHENYLPROPENONE

4(4CINNAMOYL1PIPERAZINYL)ANILINE

889944847

MFCD07601130

(E)1(4(4aminophenyl)piperazin1yl)3phenylprop2en1one

C1CN(CCN1C2=CC=C(C=C2)N)C(=O)C=CC3=CC=CC=C3

InChI=1SC19H21N3Oc20177918(10817)21121422(151321)19(23)116164213516h111H121520H2b116+


BBL000338
Synonyms: 2-chloro-N-[4-(morpholin-4-yl)-3-nitrophenyl]benzamide
Smiles: [O-][N+](=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccccc1Cl

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(O)(N+)(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccccc1Cl

2CHLORON(4(MORPHOLIN4YL)3NITROPHENYL)BENZAMIDE

2CHLORON(4MORPHOLIN4YL3NITROPHENYL)BENZAMIDE

955568179

MFCD08570060

ZINC000008902345

ZINC08902345

ZINC8902345

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Cl)(N+)(=O)(O)

InChI=1SC17H16ClN3O4c1814421313(14)17(22)19125615(16(1112)21(23)24)20792510820h1611H710H2(H1922)


BBL000339
Synonyms: 1-[4-(2-amino-6-chlorophenyl)piperazin-1-yl]-2-methylpropan-1-one
Smiles: CC(C(=O)N1CCN(CC1)c1c(N)cccc1Cl)C

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CC(C(=O)N1CCN(CC1)c1c(N)cccc1Cl)C

MFCD08133175

ZINC08703320

ZINC8703320

(3CHLORO2(4ISOBUTYRYLPIPERAZIN1YL)PHENYL)AMINE

1(4(2AMINO6CHLOROPHENYL)PIPERAZIN1YL)2METHYLPROPAN1ONE

1PROPANONE1(4(2AMINO6CHLOROPHENYL)1PIPERAZINYL)2METHYL

903432326

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)N

InChI=1SC14H20ClN3Oc110(2)14(19)188617(7918)1311(15)43512(13)16h3510H6916H212H3


BBL000340
Synonyms: [4-(4-aminophenyl)piperazin-1-yl](3,5-dimethoxyphenyl)methanone
Smiles: COc1cc(OC)cc(c1)C(=O)N1CCN(CC1)c1ccc(cc1)N

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COc1cc(OC)cc(c1)C(=O)N1CCN(CC1)c1ccc(cc1)N

(4(4(35DIMETHOXYBENZOYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINOPHENYL)PIPERAZIN1YL)(35DIMETHOXYPHENYL)METHANONE

892712640

METHANONE(4(4AMINOPHENYL)1PIPERAZINYL)(35DIMETHOXYPHENYL)

MFCD08133174

ZINC000008701342

ZINC08701342

ZINC8701342

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)N)OC

InChI=1SC19H23N3O3c124171114(1218(1317)252)19(23)229721(81022)165315(20)4616h361113H71020H212H3


BBL000341
Synonyms: [4-(4-aminophenyl)piperazin-1-yl](5-chloro-2-methoxyphenyl)methanone
Smiles: COc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(cc1)N)Cl

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COc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(cc1)N)Cl

(4(4(5CHLORO2METHOXYBENZOYL)PIPERAZIN1YL)PHENYL)AMINE

(4(4AMINOPHENYL)PIPERAZIN1YL)(5CHLORO2METHOXYPHENYL)METHANONE

4(4(5CHLORO2METHOXYBENZOYL)1PIPERAZINYL)PHENYLAMINE

892693468

METHANONE(4(4AMINOPHENYL)1PIPERAZINYL)(5CHLORO2METHOXYPHENYL)

MFCD08098384

ZINC000008701334

ZINC08701334

ZINC8701334

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)N

InChI=1SC18H20ClN3O2c124177213(19)1216(17)18(23)2210821(91122)155314(20)4615h2712H81120H21H3


BBL000342
Synonyms: 3-chloro-2-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}aniline
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1c(N)cccc1Cl

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Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1c(N)cccc1Cl

MFCD08098383

ZINC000008703292

ZINC08703292

ZINC8703292

(3CHLORO2(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)PHENYL)AMINE

3CHLORO2(4((4METHYLPHENYL)SULFONYL)1PIPERAZINYL)PHENYLAMINE

3CHLORO2(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)ANILINE

3CHLORO2(4(TOLUENE4SULFONYL)PIPERAZIN1YL)PHENYLAMINE

892693424

BENZENAMINE3CHLORO2(4((4METHYLPHENYL)SULFONYL)1PIPERAZINYL)

3chloro2(4(4methylphenyl)sulfonylpiperazin1yl)aniline

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)N

InChI=1SC17H20ClN3O2Sc1135714(8613)24(2223)2111920(101221)1715(18)32416(17)19h28H91219H21H3


BBL000343
Synonyms: 2-amino-6-methylphenol
Smiles: Oc1c(C)cccc1N

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Oc1c(C)cccc1N

OCRESOL6AMINO

PHENOL2AMINO6METHYL

ZINC000001433370

ZINC01433370

ZINC1433370

MFCD03788432

17672229

2AMINO6METHYLPHENOL

2AMINO6METHYLPHENOLHYDROCHLORDE

2HYDROXY3METHYLANILINE

3AMINO2HYDROXYTOLUENE

6AMINO2METHYLPHENOL

6AMINOOCRESOL

6AMINOOCRESOL(INCI)

6METHYL2AMINOPHENOL

6METHYLOAMINOPHENOL

CC1=C(C(=CC=C1)N)O

InChI=1SC7H9NOc153246(8)7(5)9h249H8H21H3


BBL000344
Synonyms: 4-chloro-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: Clc1ncnc2c1c1CCCCc1s2

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Clc1ncnc2c1c1CCCCc1s2

4chloro5678tetrahydro(1)benzothieno(23d)pyrimidine

MFCD00463624

ZINC000000078242

ZINC00078242

ZINC78242

40493183

4chloro5678tetrahydro(1)benzothiolo(23d)pyrimidine

C1CCC2=C(C1)C3=C(S2)N=CN=C3Cl

InChI=1SC10H9ClN2Sc1198631247(6)1410(8)135129h5H14H2


BBL000345
Synonyms: 2-[(pyridin-2-ylmethyl)amino]benzoicacid
Smiles: OC(=O)c1ccccc1NCc1ccccn1

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OC(=O)c1ccccc1NCc1ccccn1

ZINC000004413503

ZINC4413503

MFCD07395223

01025691

2((2PYRIDINYLMETHYL)AMINO)BENZOICACID

2((PYRIDIN2YLMETHYL)AMINO)BENZOICACID

2(PYRIDIN2YLMETHYLAMINO)BENZOICACID

C1=CC=C(C(=C1)C(=O)O)NCC2=CC=CC=N2

InChI=1SC13H12N2O2c1613(17)11612712(11)1591053481410h1815H9H2(H1617)


BBL000346
Synonyms: N-(3-aminophenyl)-3-methylbutanamide
Smiles: CC(CC(=O)Nc1cccc(c1)N)C

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CC(CC(=O)Nc1cccc(c1)N)C

926225629

MFCD00461050

N(3AMINOPHENYL)3METHYLBUTANAMIDE

ZINC000008703404

ZINC08703404

ZINC8703404

CC(C)CC(=O)NC1=CC=CC(=C1)N

InChI=1SC11H16N2Oc18(2)611(14)13105349(12)710h3578H612H212H3(H1314)


BBL000347
Synonyms: 3-bromo-N-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Smiles: Cc1nc2sc(c(c2c(=O)n1NC(=O)CCBr)C)C

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Cc1nc2sc(c(c2c(=O)n1NC(=O)CCBr)C)C

356586602

3BROMON(256TRIMETHYL4OXOTHIENO(23D)PYRIMIDIN3(4H)YL)PROPANAMIDE

3BROMON(256TRIMETHYL4OXOTHIENO(23D)PYRIMIDIN3YL)PROPANAMIDE

MFCD00437437

ZINC000002026554

ZINC02026554

ZINC2026554

CC1=C(SC2=C1C(=O)N(C(=N2)C)NC(=O)CCBr)C

InChI=1SC12H14BrN3O2Sc167(2)191110(6)12(18)16(8(3)1411)159(17)4513h45H213H3(H1517)


BBL000348
Synonyms: 2-[(ethylamino)methyl]benzoicacid
Smiles: CCNCc1ccccc1C(=O)O

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CCNCc1ccccc1C(=O)O

MFCD08756352

ZINC000010474759

ZINC10474759

2((ETHYLAMINO)METHYL)BENZOICACID

932231646

2(ethylaminomethyl)benzoicacid

CCNCC1=CC=CC=C1C(=O)O

InChI=1SC10H13NO2c12117853469(8)10(12)13h3611H27H21H3(H1213)


BBL000349
Synonyms: 2-methyl-3-[(pyridin-2-ylmethyl)amino]benzoicacid
Smiles: OC(=O)c1cccc(c1C)NCc1ccccn1

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OC(=O)c1cccc(c1C)NCc1ccccn1

ZINC000006701067

ZINC6701067

MFCD08068111

2METHYL3((2PYRIDINYLMETHYL)AMINO)BENZOICACID

2METHYL3((PYRIDIN2YLMETHYL)AMINO)BENZOICACID

2METHYL3(PYRIDIN2YLMETHYLAMINO)BENZOICACID

881445789

CC1=C(C=CC=C1NCC2=CC=CC=N2)C(=O)O

InChI=1SC14H14N2O2c11012(14(17)18)64713(10)1691152381511h2816H9H21H3(H1718)


BBL000350
Synonyms: 6-amino-2-bromo-3,4-dimethylphenol
Smiles: Cc1cc(N)c(c(c1C)Br)O

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Cc1cc(N)c(c(c1C)Br)O

34XYLENOL6AMINO2BROMO

6AMINO2BROMO34DIMETHYLPHENOL

854663562

MFCD08592841

ZINC000009504336

ZINC09504336

ZINC9504336

CC1=CC(=C(C(=C1C)Br)O)N

InChI=1SC8H10BrNOc1436(10)8(11)7(9)5(4)2h311H10H212H3


BBL000351
Synonyms: N-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide
Smiles: O=C(c1ccccc1)Nc1cc2c(s1)CCCC2

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O=C(c1ccccc1)Nc1cc2c(s1)CCCC2

N(4567tetrahydro1benzothiophen2yl)benzamide

MFCD00434907

51948222

ZINC000002680222

ZINC02680222

ZINC2680222

C1CCC2=C(C1)C=C(S2)NC(=O)C3=CC=CC=C3

InChI=1SC15H15NOSc1715(116213711)16141012845913(12)1814h136710H4589H2(H1617)


BBL000352
Synonyms: ethyl2-(formylamino)-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate
Smiles: O=CNc1sc(c(c1C(=O)OCC)C)C(=O)Nc1ccccc1

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O=CNc1sc(c(c1C(=O)OCC)C)C(=O)Nc1ccccc1

ZINC000000333924

ZINC00333924

ZINC333924

ETHYL2(FORMYLAMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE

ETHYL2FORMAMIDO4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE

ETHYL5(ANILINOCARBONYL)2(FORMYLAMINO)4METHYL3THIOPHENECARBOXYLATE

352554791

MFCD01241990

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC=O

InChI=1SC16H16N2O4Sc132216(21)1210(2)13(2315(12)17919)14(20)18117546811h49H3H212H3(H1719)(H1820)


BBL000353
Synonyms: ethyl2-[(5-chloropentanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: ClCCCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2

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ClCCCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2

ethyl2((5chloropentanoyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD00846564

ZINC000002026677

ZINC02026677

ZINC2026677

331760624

ethyl2(5chloropentanoylamino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCCCCl

InChI=1SC16H22ClNO3Sc122116(20)1411734812(11)2215(14)1813(19)9561017h210H21H3(H1819)


BBL000354
Synonyms: ethyl2-[(chloroacetyl)amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCl)sc(c1C)C(=O)Nc1ccccc1

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CCOC(=O)c1c(NC(=O)CCl)sc(c1C)C(=O)Nc1ccccc1

ETHYL2((2CHLOROACETYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE

ETHYL2((CHLOROACETYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE

MFCD01119022

ZINC000000792615

ZINC00792615

ZINC792615

2(2CHLOROACETYLAMINO)4METHYL5PHENYLCARBAMOYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

303136325

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CCl

InChI=1SC17H17ClN2O4Sc132417(23)1310(2)14(2516(13)2012(21)918)15(22)19117546811h48H39H212H3(H1922)(H2021)


BBL000355
Synonyms: [(4-chlorophenyl)sulfonyl]aceticacid
Smiles: OC(=O)CS(=O)(=O)c1ccc(cc1)Cl

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OC(=O)CS(=O)(=O)c1ccc(cc1)Cl

ZINC000000168228

ZINC168228

CHLOROPHENYLSULFONYLACETICACID

MFCD00201948

((4CHLOROPHENYL)SULFONYL)ACETICACID

(4CHLOROBENZENESULFONYL)ACETICACID

(4CHLOROPHENYLSULFONYL)ACETICACID

(4CHLORPHENYLSULFONYL)ACETICACID

2((4CHLOROPHENYL)SULFONY)ACETICACID

2((4CHLOROPHENYL)SULFONYL)ACETICACID

2(4CHLOROBENZENESULFONYL)ACETICACID

2(4CHLOROPHENYL)SULFONYLACETICACID

2(4CHLOROPHENYLSULFONYL)ACETICACID

3405898

4CHLOROPHENYLSULFONYLACETICACID

ACETICACID2((4CHLOROPHENYL)SULFONYL)

C1=CC(=CC=C1S(=O)(=O)CC(=O)O)Cl

InChI=1SC8H7ClO4Sc96137(426)14(1213)58(10)11h14H5H2(H1011)


BBL000356
Synonyms: 2-[(3-phenylpropyl)sulfanyl]benzoicacid
Smiles: OC(=O)c1ccccc1SCCCc1ccccc1

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OC(=O)c1ccccc1SCCCc1ccccc1

ZINC000013944175

ZINC13944175

2((3PHENYLPROPYL)SULFANYL)BENZOICACID

2((3PHENYLPROPYL)THIO)BENZOICACID

2(3PHENYLPROPYLTHIO)BENZOICACID

366801276

MFCD09271353

2(3phenylpropylsulfanyl)benzoicacid

C1=CC=C(C=C1)CCCSC2=CC=CC=C2C(=O)O

InChI=1SC16H16O2Sc1716(18)1410451115(14)191269137213813h15781011H6912H2(H1718)


BBL000357
Synonyms: 2-(ethylsulfanyl)benzoicacid
Smiles: CCSc1ccccc1C(=O)O

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CCSc1ccccc1C(=O)O

MFCD00094046

ZINC000004205620

ZINC4205620

2(ETHYLSULFANYL)BENZOICACID

2(ETHYLTHIO)BENZOICACID

21101791

2ETHYLSULFANYLBENZOICACID

2ETHYLTHIOBENZOICACID

CCSC1=CC=CC=C1C(=O)O

InChI=1SC9H10O2Sc1212864357(8)9(10)11h36H2H21H3(H1011)


BBL000358
Synonyms: [(4-chlorobenzyl)sulfonyl]aceticacid
Smiles: OC(=O)CS(=O)(=O)Cc1ccc(cc1)Cl

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OC(=O)CS(=O)(=O)Cc1ccc(cc1)Cl

ZINC000001732152

ZINC1732152

MFCD06208470

((4CHLOROBENZYL)SULFONYL)ACETICACID

(4CHLOROPHENYL)METHANESULFONYLACETICACID

(4CHLOROPHENYLMETHANESULFONYL)ACETICACID

118672201

2(((4CHLOROPHENYL)METHYL)SULFONYL)ACETICACID

2((4CHLOROPHENYL)METHYLSULFONYL)ACETICACID

2(4CHLOROBENZYLSULFONYL)ACETICACID

4CHLOROBENZYLSULFONYLACETICACID

ACETICACID2(((4CHLOROPHENYL)METHYL)SULFONYL)

C1=CC(=CC=C1CS(=O)(=O)CC(=O)O)Cl

InChI=1SC9H9ClO4Sc108317(248)515(1314)69(11)12h14H56H2(H1112)


BBL000359
Synonyms: (benzylsulfonyl)aceticacid
Smiles: OC(=O)CS(=O)(=O)Cc1ccccc1

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OC(=O)CS(=O)(=O)Cc1ccccc1

PHENYLMETHANESULFONYLACETICACID

ZINC000001713408

ZINC1713408

MFCD07186552

((PHENYLMETHYL)SULFONYL)ACETICACID

(BENZYLSULFONYL)ACETICACID

2(BENZYLSULFONYL)ACETICACID

28203590

2BENZYLSULFONYLACETICACID

ACETICACID2((PHENYLMETHYL)SULFONYL)

BENZYLSULFONYLACETICACID

C1=CC=C(C=C1)CS(=O)(=O)CC(=O)O

InChI=1SC9H10O4Sc109(11)714(1213)68421358h15H67H2(H1011)


BBL000360
Synonyms: 3-(propanoylamino)benzoicacid
Smiles: CCC(=O)Nc1cccc(c1)C(=O)O

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CCC(=O)Nc1cccc(c1)C(=O)O

MFCD03604396

ZINC000007260694

ZINC7260694

3(PROPANOYLAMINO)BENZOICACID

3(PROPANYLAMINO)BENZOICACID

3(PROPIONYLAMINO)BENZOICACID

3PROPANAMIDOBENZOICACID

3PROPIONAMIDOBENZOICACID

76208996

CCC(=O)NC1=CC=CC(=C1)C(=O)O

InChI=1SC10H11NO3c129(12)1185347(68)10(13)14h36H2H21H3(H1112)(H1314)


BBL000361
Synonyms: 3-(benzylsulfonyl)propanoicacid
Smiles: OC(=O)CCS(=O)(=O)Cc1ccccc1

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OC(=O)CCS(=O)(=O)Cc1ccccc1

ZINC000004512996

ZINC4512996

MFCD00224765

3(BENZYLSULFONYL)PROPANOICACID

3BENZYLSULFONYLPROPANOICACID

3PHENYLMETHANESULFONYLPROPANOICACID

3PHENYLMETHANESULFONYLPROPIONICACID

90396024

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)O

InChI=1SC10H12O4Sc1110(12)6715(1314)89421359h15H68H2(H1112)


BBL000362
Synonyms: 2-[(2-phenoxyethyl)sulfanyl]benzoicacid
Smiles: OC(=O)c1ccccc1SCCOc1ccccc1

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OC(=O)c1ccccc1SCCOc1ccccc1

ZINC000013944176

ZINC13944176

2((2PHENOXYETHYL)SULFANYL)BENZOICACID

2((2PHENOXYETHYL)THIO)BENZOICACID

2(2PHENOXYETHYLTHIO)BENZOICACID

931374720

MFCD09271354

2(2phenoxyethylsulfanyl)benzoicacid

C1=CC=C(C=C1)OCCSC2=CC=CC=C2C(=O)O

InChI=1SC15H14O3Sc1615(17)13845914(13)19111018126213712h19H1011H2(H1617)


BBL000363
Synonyms: 3,5-dibromo-6-methylpyridin-2-amine
Smiles: Brc1cc(Br)c(nc1C)N

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Brc1cc(Br)c(nc1C)N

MFCD00068229

ZINC000018210612

ZINC18210612

2AMINO35DIBROM6METHYLPYRIDINE

2AMINO35DIBROMO6METHYLPYRIDINE

2AMINO35DIBROMO6PICOLINE

2PYRIDINAMINE35DIBROMO6METHYL

35DIBROMO6METHYL2PYRIDINAMINE

35DIBROMO6METHYL2PYRIDYLAMINE

35DIBROMO6METHYLPYRIDIN2AMINE

35DIBROMO6METHYLPYRIDIN2YLAMINE

6AMINO35DIBROMO2PICOLINE

91872105

CC1=NC(=C(C=C1Br)Br)N

InChI=1SC6H6Br2N2c134(7)25(8)6(9)103h2H1H3(H2910)


BBL000364
Synonyms: [(4-nitrobenzyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCc1ccc(cc1)[N+](=O)[O-]

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OC(=O)CSCc1ccc(cc1)(N+)(=O)(O)

ZINC000000263444

ZINC263444

MFCD00540019

(((4NITROPHENYL)METHYL)SULFANYL)ACETICACID

((4NITROBENZYL)SULFANYL)ACETICACID

((4NITROBENZYL)THIO)ACETICACID

((4NITROPHENYL)METHYLTHIO)ETHANOICACID

(4NITROBENZYLTHIO)ACETICACID

2((4NITROPHENYL)METHYLSULFANYL)ACETICACID

2((4NITROPHENYL)METHYLTHIO)ACETICACID

6345137

ACETICACID2(((4NITROPHENYL)METHYL)THIO)

C1=CC(=CC=C1CSCC(=O)O)(N+)(=O)(O)

InChI=1SC9H9NO4Sc119(12)61557138(427)10(13)14h14H56H2(H1112)


BBL000365
Synonyms: 4-ethoxybenzene-1,2-diamine
Smiles: CCOc1ccc(c(c1)N)N

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CCOc1ccc(c(c1)N)N

MFCD00640896

OPHENYLENEDIAMINE4ETHOXY

ZINC000001477244

ZINC01477244

ZINC1477244

1197371

12BENZENEDIAMINE4ETHOXY

12DIAMINO4ETHOXYBENZENE

2AMINO4ETHOXYPHENYLAMINE

34DIAMINOPHENETOLE

4ETHOXY12BENZENEDIAMINE

4ETHOXY12DIAMINOBENZENE

4ETHOXY12PHENYLENEDIAMINE

4ETHOXYBENZENE12DIAMINE

CCOC1=CC(=C(C=C1)N)N

InChI=1SC8H12N2Oc12116347(9)8(10)56h35H2910H21H3


BBL000366
Synonyms: 2-(propan-2-ylsulfanyl)benzoicacid
Smiles: CC(Sc1ccccc1C(=O)O)C

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CC(Sc1ccccc1C(=O)O)C

MFCD07364761

ZINC000006884162

ZINC6884162

2(ISOPROPYLSULFANYL)BENZOICACID

2(ISOPROPYLTHIO)BENZOICACID

2(METHYLETHYLTHIO)BENZOICACID

2(PROPAN2YLSULFANYL)BENZOICACID

2ISOPROPYLMERCAPTOBENZOICACID

2ISOPROPYLSULFANYLBENZOICACID

2PROPAN2YLSULFANYLBENZOICACID

41394950

BENZOICACID2((1METHYLETHYL)THIO)

CC(C)SC1=CC=CC=C1C(=O)O

InChI=1SC10H12O2Sc17(2)13964358(9)10(11)12h37H12H3(H1112)


BBL000367
Synonyms: 2-(butylsulfanyl)benzoicacid
Smiles: CCCCSc1ccccc1C(=O)O

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CCCCSc1ccccc1C(=O)O

MFCD07364775

ZINC000007262012

ZINC7262012

17839611

2(BUTYLSULFANYL)BENZOICACID

2(BUTYLTHIO)BENZOICACID

2BUTYLSULFANYLBENZOICACID

2BUTYLTHIOBENZOICACID

CCCCSC1=CC=CC=C1C(=O)O

InChI=1SC11H14O2Sc1238141075469(10)11(12)13h47H238H21H3(H1213)


BBL000368
Synonyms: 2-(propylsulfanyl)benzoicacid
Smiles: CCCSc1ccccc1C(=O)O

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CCCSc1ccccc1C(=O)O

MFCD02729229

ZINC000001662527

ZINC1662527

2(PROPYLSULFANYL)BENZOICACID

2(PROPYLTHIO)BENZOICACID

21213105

2PROPYLSULFANYLBENZOICACID

2PROPYLTHIOBENZOICACID

BENZOICACID2(PROPYLTHIO)

CCCSC1=CC=CC=C1C(=O)O

InChI=1SC10H12O2Sc12713964358(9)10(11)12h36H27H21H3(H1112)


BBL000369
Synonyms: 3-bromo-4-(morpholin-4-yl)aniline
Smiles: Nc1ccc(c(c1)Br)N1CCOCC1

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Nc1ccc(c(c1)Br)N1CCOCC1

ZINC00037791

ZINC37791

(3BROMO4MORPHOLIN4YLPHENYL)AMINE

347324269

3BROMO4(MORPHOLIN4YL)ANILINE

3BROMO4MORPHOLIN4YLANILINE

3BROMO4MORPHOLIN4YLPHENYLAMINE

3BROMO4MORPHOLINOANILINE

C1COCCN1C2=C(C=C(C=C2)N)Br

InChI=1SC10H13BrN2Oc11978(12)1210(9)1335146413h127H3612H2


BBL000370
Synonyms: 1-(2,5-dimethylphenyl)-5-oxopyrrolidine-3-carboxylicacid
Smiles: Cc1ccc(cc1N1CC(CC1=O)C(=O)O)C

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Cc1ccc(cc1N1CC(CC1=O)C(=O)O)C

MFCD00469835

ZINC000004724360

ZINC000004724361

1(25DIMETHYLPHENYL)5OXOPYRROLIDINE3CARBOXYLICACID

3PYRROLIDINECARBOXYLICACID1(25DIMETHYLPHENYL)5OXO

63674680

CC1=CC(=C(C=C1)C)N2CC(CC2=O)C(=O)O

InChI=1SC13H15NO3c18349(2)11(58)14710(13(16)17)612(14)15h3510H67H212H3(H1617)


BBL000371
Synonyms: 3-(pentanoylamino)benzoicacid
Smiles: CCCCC(=O)Nc1cccc(c1)C(=O)O

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CCCCC(=O)Nc1cccc(c1)C(=O)O

MFCD00448067

ZINC000012274134

ZINC12274134

174482770

3(PENTANOYLAMINO)BENZOICACID

3PENTANAMIDOBENZOICACID

CCCCC(=O)NC1=CC=CC(=C1)C(=O)O

InChI=1SC12H15NO3c123711(14)13106459(810)12(15)16h468H237H21H3(H1314)(H1516)


BBL000372
Synonyms: 4-[(2-ethylbutanoyl)amino]benzoicacid
Smiles: CCC(C(=O)Nc1ccc(cc1)C(=O)O)CC

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CCC(C(=O)Nc1ccc(cc1)C(=O)O)CC

MFCD03235452

ZINC000007260761

ZINC7260761

4((2ETHYLBUTANOYL)AMINO)BENZOICACID

4(2ETHYLBUTANAMIDO)BENZOICACID

4(2ETHYLBUTANOYLAMINO)BENZOICACID

486440986

CCC(CC)C(=O)NC1=CC=C(C=C1)C(=O)O

InChI=1SC13H17NO3c139(42)12(15)14117510(6811)13(16)17h59H34H212H3(H1415)(H1617)


BBL000373
Synonyms: [(4-fluorobenzyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCc1ccc(cc1)F

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OC(=O)CSCc1ccc(cc1)F

ZINC000000266727

ZINC266727

MFCD03407477

(((4FLUOROPHENYL)METHYL)SULFANYL)ACETICACID

((4FLUOROBENZYL)SULFANYL)ACETICACID

((4FLUOROBENZYL)THIO)ACETICACID

2(((4FLUOROPHENYL)METHYL)SULFANYL)ACETICACID

2((4FLUOROPHENYL)METHYLSULFANYL)ACETICACID

2((4FLUOROPHENYL)METHYLTHIO)ACETICACID

65051243

C1=CC(=CC=C1CSCC(=O)O)F

InChI=1SC9H9FO2Sc108317(248)51369(11)12h14H56H2(H1112)


BBL000374
Synonyms: 1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)CCc1ccc(cc1)F

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OC(=O)C1CC(=O)N(C1)CCc1ccc(cc1)F

ZINC000004384217

ZINC000004384218

MFCD07186388

1(2(4FLUOROPHENYL)ETHYL)5OXOPYRROLIDINE3CARBOXYLICACID

1(4FLUOROPHENETHYL)5OXOPYRROLIDINE3CARBOXYLICACID

842971840

C1C(CN(C1=O)CCC2=CC=C(C=C2)F)C(=O)O

InChI=1SC13H14FNO3c1411319(2411)5615810(13(17)18)712(15)16h1410H58H2(H1718)


BBL000375
Synonyms: 6-(3-chloro-4-methylphenyl)-3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1cc(ccc1C)c1sc2n(n1)c(nn2)C

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Clc1cc(ccc1C)c1sc2n(n1)c(nn2)C

6(3CHLORO4METHYLPHENYL)3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

945317168

MFCD09453619

ZINC000016647482

ZINC16647482

CC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)C)Cl

InChI=1SC11H9ClN4Sc16348(59(6)12)1015167(2)131411(16)1710h35H12H3


BBL000376
Synonyms: N-[4-(3-aminophenyl)-1,3-thiazol-2-yl]propanamide
Smiles: CCC(=O)Nc1scc(n1)c1cccc(c1)N

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CCC(=O)Nc1scc(n1)c1cccc(c1)N

952917123

MFCD09754374

N(4(3AMINOPHENYL)13THIAZOL2YL)PROPANAMIDE

N(4(3AMINOPHENYL)THIAZOL2YL)PROPIONAMIDE

ZINC000012860997

ZINC12860997

CCC(=O)NC1=NC(=CS1)C2=CC(=CC=C2)N

InChI=1SC12H13N3OSc1211(16)15121410(71712)84359(13)68h37H213H21H3(H141516)


BBL000377
Synonyms: 2-methyl-4-(6-methyl-1,3-benzoxazol-2-yl)aniline
Smiles: Cc1ccc2c(c1)oc(n2)c1ccc(c(c1)C)N

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Cc1ccc2c(c1)oc(n2)c1ccc(c(c1)C)N

ZINC20134490

2METHYL4(6METHYL13BENZOXAZOL2YL)ANILINE

2METHYL4(6METHYLBENZOOXAZOL2YL)PHENYLAMINE

952901370

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)N)C

InChI=1SC15H14N2Oc19361314(79)1815(1713)114512(16)10(2)811h38H16H212H3


BBL000378
Synonyms: 1-[2-(5-chloro-1H-indol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)CCc1c[nH]c2c1cc(Cl)cc2

more...



OC(=O)C1CC(=O)N(C1)CCc1c(nH)c2c1cc(Cl)cc2

1(2(5CHLORO1HINDOL3YL)ETHYL)5OXOPYRROLIDINE3CARBOXYLICACID

1(2(5CHLOROINDOL3YL)ETHYL)5OXOPYRROLIDINE3CARBOXYLICACID

931374753

C1C(CN(C1=O)CCC2=CNC3=C2C=C(C=C3)Cl)C(=O)O

InChI=1SC15H15ClN2O3c1611121312(611)9(71713)3418810(15(20)21)514(18)19h12671017H358H2(H2021)


BBL000379
Synonyms: 2-bromo-4,6-difluoroaniline
Smiles: Fc1cc(F)c(c(c1)Br)N

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Fc1cc(F)c(c(c1)Br)N

ZINC00152682

ZINC152682

24DIFLUORO6BROMOANILINE

2BROMANYL46BIS(FLUORANYL)ANILINE

2BROMO46DIFLUOROANILINE

2BROMO46DIFLUOROBENZENAMINE

2BROMO46DIFLUOROPHENYLAMINE

444144

6BROMO24DIFLUOROANILINE

BENZENAMINE2BROMO46DIFLUORO

C1=C(C=C(C(=C1F)N)Br)F

InChI=1SC6H4BrF2Nc7413(8)25(9)6(4)10h12H10H2


BBL000380
Synonyms: 1-methyl-1H-pyrazole-5-carbonitrile
Smiles: Cn1nccc1C#N

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Cn1nccc1C#N

ZINC12396642

1HPYRAZOLE5CARBONITRILE1METHYL

1METHYL1HPYRAZOLE5CARBONITRILE

1METHYLPYRAZOLE5CARBONITRILE

2METHYL2HPYRAZOLE3CARBONITRILE

2METHYLPYRAZOLE3CARBONITRILE

66121720


BBL000381
Synonyms: ethyl3-(2-ethoxy-2-oxoethyl)-1H-indole-2-carboxylate
Smiles: CCOC(=O)Cc1c([nH]c2c1cccc2)C(=O)OCC

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CCOC(=O)Cc1c((nH)c2c1cccc2)C(=O)OCC

ETHYL2CARBOETHOXY3INDOLEACETATE

ETHYL3(2ETHOXY2OXOETHYL)1HINDOLE2CARBOXYLATE

(2ETHOXYCARBONYLINDOL3YL)ACETICACIDETHYLESTER

2(ETHOXYCARBONYL)1HINDOLE3ACETICACIDETHYLESTER

63158601

MFCD00426373

ZINC000018193574

ZINC18193574

CCOC(=O)CC1=C(NC2=CC=CC=C21)C(=O)OCC

InChI=1SC15H17NO4c131913(17)91110756812(10)1614(11)15(18)2042h5816H349H212H3


BBL000382
Synonyms: 4-(dimethylamino)-3-nitrobenzonitrile
Smiles: N#Cc1ccc(c(c1)[N+](=O)[O-])N(C)C

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N#Cc1ccc(c(c1)(N+)(=O)(O))N(C)C

ZINC05393762

ZINC5393762

19005631

3NITRO4DIMETHYLAMINOBENZONITRILE

4(DIMETHYLAMINO)3NITROBENZONITRILE

4DIMETHYLAMINO3NITROBENZONITRILE

BENZONITRILE4(DIMETHYLAMINO)3NITRO

CN(C)C1=C(C=C(C=C1)C#N)(N+)(=O)(O)

InChI=1SC9H9N3O2c111(2)8437(610)59(8)12(13)14h35H12H3


BBL000383
Synonyms: 4-chloro-1-ethyl-1H-pyrazol-3-amine
Smiles: CCn1cc(c(n1)N)Cl

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CCn1cc(c(n1)N)Cl

ZINC02537813

ZINC2537813

1006333307

4CHLORO1ETHYL1HPYRAZOL3AMINE

4CHLORO1ETHYLPYRAZOLE3YLAMINE

4chloro1ethylpyrazol3amine

CCN1C=C(C(=N1)N)Cl

InChI=1SC5H8ClN3c12934(6)5(7)89h3H2H21H3(H278)


BBL000384
Synonyms: 3-(2-nitrophenyl)-2H-chromen-2-one
Smiles: O=c1oc2ccccc2cc1c1ccccc1[N+](=O)[O-]

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O=c1oc2ccccc2cc1c1ccccc1(N+)(=O)(O)

ZINC000020134578

ZINC20134578

MFCD09754377

107623767

3(2NITROPHENYL)2HCHROMEN2ONE

3(2NITROPHENYL)CHROMEN2ONE

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC=CC=C3(N+)(=O)(O)

InChI=1SC15H9NO4c171512(910514814(10)2015)11623713(11)16(18)19h19H


BBL000385
Synonyms: 2-amino-6-bromo-4-methylphenol
Smiles: Cc1cc(N)c(c(c1)Br)O

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Cc1cc(N)c(c(c1)Br)O

2AMINO6BROMO4METHYLPHENOL

343269512

MFCD09754409

ZINC000020134800

ZINC20134800

CC1=CC(=C(C(=C1)Br)O)N

InChI=1SC7H8BrNOc1425(8)7(10)6(9)34h2310H9H21H3


BBL000386
Synonyms: N-phenylnaphthalen-2-amine
Smiles: c1ccc(cc1)Nc1ccc2c(c1)cccc2

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c1ccc(cc1)Nc1ccc2c(c1)cccc2

FENYLBETANAFTYLAMIN

MFCD00004052

N(2NAPHTHYL)ANILINE

N(2NAPHTHYL)NPHENYLAMINE

N2NAPHTHYLANILINE

NBETANAPHTHYLNPHENYLAMINE

NFENYL2AMINONAFTALEN

NPHENYL2NAPHTHALENAMINE

NPHENYL2NAPHTHYLAMINE

NPHENYLBETAAMINONAPHTHALENE

NPHENYLBETANAPHTHYLAMINE

NPHENYLNAPHTHALEN2AMINE

135886

2(NPHENYLAMINO)NAPHTHALENE

PHENYL2NAPHTHYLAMINE

PHENYLBETANAPHTHYLAMINE

PHENYLBETANAPHTILAMINE

ZINC000001669780

ZINC01669780

ZINC1669780

2ANILINONAPHTHALENE

2NAPHTHALENAMINENPHENYL

2NAPHTHYLAMINENPHENYL

2NAPHTHYLPHENYLAMINE

2PHENYLAMINONAPHTHALENE

ACETOPBN

ANILINONAPHTHALENE

BETANAPHTHYLPHENYLAMINE

C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2

InChI=1SC16H13Nc12815(931)1716111013645714(13)1216h11217H


BBL000387
Synonyms: 3-chloro-4-methyl-5-nitrobenzoicacid
Smiles: [O-][N+](=O)c1cc(cc(c1C)Cl)C(=O)O

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(O)(N+)(=O)c1cc(cc(c1C)Cl)C(=O)O

181871692

3CHLORO4METHYL5NITROBENZOICACID

MFCD11557521

ZINC000026508312

ZINC26508312

CC1=C(C=C(C=C1Cl)C(=O)O)(N+)(=O)(O)

InChI=1SC8H6ClNO4c146(9)25(8(11)12)37(4)10(13)14h23H1H3(H1112)


BBL000388
Synonyms: 4-amino-3-chlorobenzenesulfonate
Smiles: Nc1ccc(cc1Cl)S(=O)(=O)[O-]

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Nc1ccc(cc1Cl)S(=O)(=O)(O)

ZINC000001689743

ZINC01689743

MFCD00025154

4AMINO3CHLOROBENZENESULFONATE

4AMINO3CHLOROBENZENESULFONICACIDANION

98351

C1=CC(=C(C=C1S(=O)(=O)(O))Cl)N

InChI=1SC6H6ClNO3Sc7534(12(910)11)126(5)8h13H8H2(H91011)p1


BBL000389
Synonyms: 2-hydrazinyl-4-phenyl-1,3-benzothiazole
Smiles: NNc1sc2c(n1)c(ccc2)c1ccccc1

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NNc1sc2c(n1)c(ccc2)c1ccccc1

ZINC000026508221

ZINC26508221

MFCD11557500

(4PHENYLBENZOTHIAZOL2YL)HYDRAZINE

1092306392

2HYDRAZINO4PHENYL13BENZOTHIAZOLE

2HYDRAZINYL4PHENYL13BENZOTHIAZOLE

2HYDRAZINYL4PHENYLBENZO(D)THIAZOLE

4PHENYLBENZOTHIAZOLE2YLHYDRAZINE

(4phenyl13benzothiazol2yl)hydrazine

C1=CC=C(C=C1)C2=C3C(=CC=C2)SC(=N3)NN

InChI=1SC13H11N3Sc141613151210(74811(12)1713)9521369h18H14H2(H1516)


BBL000390
Synonyms: 1-chloro-4-methoxy-2-nitrobenzene
Smiles: COc1ccc(c(c1)[N+](=O)[O-])Cl

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COc1ccc(c(c1)(N+)(=O)(O))Cl

MFCD00007077

ZINC000001679197

ZINC01679197

ZINC1679197

10298803

1CHLORO4METHOXY2NITROBENZENE

2CHLORO5METHOXYNITROBENZENE

3NITRO4CHLOROANISOLE

4CHLORO3NITROANISOL

4CHLORO3NITROANISOLE

4METHOXY2NITROCHLOROBENZENE

ANISOLE4CHLORO3NITRO

BENZENE1CHLORO4METHOXY2NITRO

BENZENE1CHLORO4METHOXY2NITRO(9CI)

COC1=CC(=C(C=C1)Cl)(N+)(=O)(O)

InChI=1SC7H6ClNO3c1125236(8)7(45)9(10)11h24H1H3


BBL000391
Synonyms: 4,4'-(1,1,1,3,3,3-hexafluoropropane-2,2-diyl)bis(2-aminophenol)
Smiles: Oc1ccc(cc1N)C(C(F)(F)F)(C(F)(F)F)c1ccc(c(c1)N)O

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Oc1ccc(cc1N)C(C(F)(F)F)(C(F)(F)F)c1ccc(c(c1)N)O

44(111333hexafluoropropane22diyl)bis(2aminophenol)

44(HEXAFLUOROISOPROPYLIDENE)BIS(2AMINOPHENOL)

44(PERFLUOROPROPANE22DIYL)BIS(2AMINOPHENOL)

83558876

11BIS(3AMINO4HYDROXYPHENYL)222TRIFLUORO1(TRIFLUOROMETHYL)ETHANE

22BIS(3AMINO4HYDROPHENYL)HEXAFLUOROPROPANE

22BIS(3AMINO4HYDROXYPHENYL)HEXAFLUOROPROPANE

22BIS(4HYDROXYL3AMINOPHENYL)HEXAFLUOROPROPANE

22DIAMINO44(PERFLUOROPROPANE22DIYL)DIPHENOL

2AMINO4(1(3AMINO4HYDROXYPHENYL)222TRIFLUORO1(TRIFLUOROMETHYL)ETHYL)PHENOL

PHENOL44(222TRIFLUORO1(TRIFLUOROMETHYL)ETHYLIDENE)BIS(2AMINO

ZINC000002168346

ZINC02168346

ZINC2168346

MFCD00039147

2amino4(2(3amino4hydroxyphenyl)111333hexafluoropropan2yl)phenol

C1=CC(=C(C=C1C(C2=CC(=C(C=C2)O)N)(C(F)(F)F)C(F)(F)F)N)O

InChI=1SC15H12F6N2O2c1614(1718)13(15(1920)2171311(24)9(22)57)82412(25)10(23)68h162425H2223H2


BBL000392
Synonyms: N~1~-methyl-4-nitrobenzene-1,2-diamine
Smiles: CNc1ccc(cc1N)[N+](=O)[O-]

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CNc1ccc(cc1N)(N+)(=O)(O)

N~1~methyl4nitrobenzene12diamine

N1METHYL4NITRO12BENZENEDIAMINE

N1METHYL4NITRO12PHENYLENEDIAMINE

N1METHYL4NITROBENZENE12DIAMINE

NMETHYL4NITRO12BENZENEDIAMINE

ZINC000004774771

ZINC04774771

ZINC4774771

12BENZENEDIAMINEN1METHYL4NITRO

12DIAMINON1METHYL4NITROBENZENE

1NMETHYL4NITROBENZENE12DIAMINE

2AMINO1METHYLAMINO4NITROBENZENE

2AMINO4NITRONMETHYLANILINE

2METHYLAMINO5NITROANILINE

41939611

METHYLNITROBENZENEDIAMINE

MFCD00156607

N(2AMINO4NITROPHENYL)NMETHYLAMINE

CNC1=C(C=C(C=C1)(N+)(=O)(O))N

InChI=1SC7H9N3O2c197325(10(11)12)46(7)8h249H8H21H3


BBL000393
Synonyms: N-(2-methylpropyl)prop-2-en-1-amine
Smiles: C=CCNCC(C)C

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C=CCNCC(C)C

06042424

MFCD09837547

N(2METHYLPROPYL)PROP2EN1AMINE

NISOBUTYL2PROPEN1AMINE

NISOBUTYLALLYLAMINE

ZINC000015414085

ZINC15414085

2methylNprop2enylpropan1amine

CC(C)CNCC=C

InChI=1SC7H15Nc145867(2)3h478H156H223H3


BBL000394
Synonyms: 2-hydrazinylnaphtho[2,1-d][1,3]thiazole
Smiles: NNc1nc2c(s1)c1ccccc1cc2

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NNc1nc2c(s1)c1ccccc1cc2

ZINC000032500105

ZINC32500105

MFCD11868165

NAPHTHO(21D)THIAZOL2YLHYDRAZINE

(NAPHTHO(21D)(13)THIAZOL2YL)HYDRAZINE

14889088

2HYDRAZINYLNAPHTHO(21D)(13)THIAZOLE

benzo(g)(13)benzothiazol2ylhydrazine

C1=CC=C2C(=C1)C=CC3=C2SC(=N3)NN

InChI=1SC11H9N3Sc12141113965731248(7)10(9)1511h16H12H2(H1314)


BBL000395
Synonyms: N-[(5-methylfuran-2-yl)methyl]ethanamine
Smiles: CCNCc1ccc(o1)C

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CCNCc1ccc(o1)C

ETHYL(5METHYLFURAN2YLMETHYL)AMINE

175915125

MFCD06740630

N((5METHYL2FURYL)METHYL)ETHANAMINE

N((5METHYL2FURYL)METHYL)ETHANAMINEHYDROCHLORIDE

N((5METHYLFURAN2YL)METHYL)ETHANAMINE

ZINC000004298822

ZINC4298822

CCNCC1=CC=C(O1)C

InChI=1SC8H13NOc13968547(2)108h459H36H212H3


BBL000396
Synonyms: 2-(butylsulfonyl)benzoicacid
Smiles: CCCCS(=O)(=O)c1ccccc1C(=O)O

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CCCCS(=O)(=O)c1ccccc1C(=O)O

MFCD09947080

ZINC000019510734

ZINC19510734

2(BUTANE1SULFONYL)BENZOICACID

2(BUTYLSULFONYL)BENZOICACID

57076150

2butylsulfonylbenzoicacid

CCCCS(=O)(=O)C1=CC=CC=C1C(=O)O

InChI=1SC11H14O4Sc123816(1415)1075469(10)11(12)13h47H238H21H3(H1213)


BBL000397
Synonyms: 6-chloro-1,3-benzoxazol-2-amine
Smiles: Clc1ccc2c(c1)oc(n2)N

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Clc1ccc2c(c1)oc(n2)N

ZINC08614805

ZINC8614805

2AMINO6CHLOROBENZOXAZOLE

2BENZOXAZOLAMINE6CHLORO

2BENZOXAZOLAMINE6CHLORO(9CI)

52112682

6CHLORANYL13BENZOXAZOL2AMINE

6CHLORO13BENZOXAZOL2AMINE

6CHLORO2BENZOXAZOLAMINE

6CHLOROBENZO(D)OXAZOL2AMINE

6CHLOROBENZOOXAZOL2YLAMINE

BENZOXAZOLE2AMINO6CHLORO

C1=CC2=C(C=C1Cl)OC(=N2)N

InChI=1SC7H5ClN2Oc841256(34)117(9)105h13H(H2910)


BBL000398
Synonyms: 5-chloro-4-methyl-2-nitroaniline
Smiles: [O-][N+](=O)c1cc(C)c(cc1N)Cl

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(O)(N+)(=O)c1cc(C)c(cc1N)Cl

4AMINO2CHLORO5NITROTOLUENE

5CHLORO2NITROPTOLUIDINE

5CHLORO4METHYL2NITROANILINE

5CHLORO4METHYL2NITROPHENYLAMINE

7149806

BENZENAMINE5CHLORO4METHYL2NITRO

MFCD00034066

ZINC000004284009

ZINC04284009

ZINC4284009

CC1=CC(=C(C=C1Cl)N)(N+)(=O)(O)

InChI=1SC7H7ClN2O2c1427(10(11)12)6(9)35(4)8h23H9H21H3


BBL000399
Synonyms: 1-iodo-4-methoxy-2-nitrobenzene
Smiles: COc1ccc(c(c1)[N+](=O)[O-])I

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COc1ccc(c(c1)(N+)(=O)(O))I

MFCD00024195

ZINC000001606074

ZINC01606074

ZINC1606074

1IODO2NITRO4METHOXYBENZENE

1IODO4METHOXY2NITROBENZENE

2IODO5METHOXYNITROBENZENE

3NITRO4IODOANISOL

3NITRO4IODOANISOLE

4IODO3NITROANISOLE

58755707

BENZENE1IODO4METHOXY2NITRO

COC1=CC(=C(C=C1)I)(N+)(=O)(O)

InChI=1SC7H6INO3c1125236(8)7(45)9(10)11h24H1H3


BBL000400
Synonyms: 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)cyclohexanecarboxylicacid
Smiles: OC(=O)C1CCC(CC1)N1C(=O)C2C(C1=O)C1CC2C=C1

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4(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)CYCLOHEXANECARBOXYLICACID

474091026

MFCD02870828

ZINC000006673034

ZINC000100149599

ZINC000100834566

C1CC(CCC1C(=O)O)N2C(=O)C3C4CC(C3C2=O)C=C4

InChI=1SC16H19NO4c18141291210(79)13(12)15(19)17(14)11538(4611)16(20)21h12813H37H2(H2021)


BBL000401
Synonyms: 2-[(2-methoxyethyl)sulfonyl]benzoicacid
Smiles: COCCS(=O)(=O)c1ccccc1C(=O)O

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COCCS(=O)(=O)c1ccccc1C(=O)O

MFCD09947378

ZINC000019511493

ZINC19511493

1016838053

2((2METHOXYETHYL)SULFONYL)BENZOICACID

2(2METHOXYETHANESULFONYL)BENZOICACID

2(2methoxyethylsulfonyl)benzoicacid

COCCS(=O)(=O)C1=CC=CC=C1C(=O)O

InChI=1SC10H12O5Sc1156716(1314)953248(9)10(11)12h25H67H21H3(H1112)


BBL000402
Synonyms: 2,3-diamino-5-methoxyphenylthiocyanate
Smiles: N#CSc1cc(OC)cc(c1N)N

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N#CSc1cc(OC)cc(c1N)N

ZINC000039315682

ZINC39315682

MFCD13187124

1192806191

23DIAMINO5METHOXYPHENYLTHIOCYANATE

(23diamino5methoxyphenyl)thiocyanate

COC1=CC(=C(C(=C1)N)N)SC#N

InChI=1SC8H9N3OSc112526(10)8(11)7(35)1349h23H1011H21H3


BBL000403
Synonyms: 2-{[2-(2-chlorophenyl)ethyl]sulfanyl}benzoicacid
Smiles: Clc1ccccc1CCSc1ccccc1C(=O)O

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Clc1ccccc1CCSc1ccccc1C(=O)O

ZINC34927178

2((2(2CHLOROPHENYL)ETHYL)SULFANYL)BENZOICACID

2((2(2CHLOROPHENYL)ETHYL)THIO)BENZOICACID


BBL000404
Synonyms: 2-{[2-(4-chlorophenyl)ethyl]sulfanyl}benzoicacid
Smiles: Clc1ccc(cc1)CCSc1ccccc1C(=O)O

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Clc1ccc(cc1)CCSc1ccccc1C(=O)O

ZINC34927177

2((2(4CHLOROPHENYL)ETHYL)SULFANYL)BENZOICACID

2((2(4CHLOROPHENYL)ETHYL)THIO)BENZOICACID


BBL000405
Synonyms: 3-amino-5-bromobiphenyl-4-ol
Smiles: Nc1cc(cc(c1O)Br)c1ccccc1

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Nc1cc(cc(c1O)Br)c1ccccc1

ZINC000035655362

ZINC35655362

1158580609

3AMINO5BROMO(11BIPHENYL)4OL

3AMINO5BROMOBIPHENYL4OL

6AMINO2BROMO4PHENYLPHENOL

MFCD12402412

2amino6bromo4phenylphenol

C1=CC=C(C=C1)C2=CC(=C(C(=C2)Br)O)N

InChI=1SC12H10BrNOc131069(711(14)12(10)15)8421358h1715H14H2


BBL000406
Synonyms: 2-hydrazinyl-1,3-benzothiazole-6-carbohydrazide
Smiles: NNc1sc2c(n1)ccc(c2)C(=O)NN

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NNc1sc2c(n1)ccc(c2)C(=O)NN

ZINC000008729882

ZINC08729882

ZINC8729882

2HYDRAZINO13BENZOTHIAZOLE6CARBOHYDRAZIDE

2HYDRAZINOBENZOTHIAZOLE6CARBOHYDRAZIDE

2HYDRAZINYL13BENZOTHIAZOLE6CARBOHYDRAZIDE

2HYDRAZINYLBENZO(D)THIAZOLE6CARBOHYDRAZIDE

924869078

HYDRAZINOBENZOTHIAZOLECARBOHYDRAZIDE

MFCD08444017

C1=CC2=C(C=C1C(=O)NN)SC(=N2)NN

InChI=1SC8H9N5OSc9127(14)41256(34)158(115)1310h13H910H2(H1113)(H1214)


BBL000407
Synonyms: 3-bromo-5-[(E)-phenyldiazenyl]biphenyl-4-ol
Smiles: Oc1c(Br)cc(cc1/N=N/c1ccccc1)c1ccccc1

more...



Oc1c(Br)cc(cc1N=Nc1ccccc1)c1ccccc1

3bromo5((E)phenyldiazenyl)biphenyl4ol

MFCD13372573

ZINC000039315679

1192823929


BBL000408
Synonyms: 6-methyl-4-oxo-1-propyl-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCCn1cc(C(=O)O)c(=O)c2c1ccc(c2)C

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CCCn1cc(C(=O)O)c(=O)c2c1ccc(c2)C

ZINC26507987

1092288975

6METHYL4OXO1PROPYL14DIHYDROQUINOLINE3CARBOXYLICACID

6methyl4oxo1propylquinoline3carboxylicacid

CCCN1C=C(C(=O)C2=C1C=CC(=C2)C)C(=O)O

InChI=1SC14H15NO3c13615811(14(17)18)13(16)1079(2)4512(10)15h4578H36H212H3(H1718)


BBL000409
Synonyms: ethyl5-(chlorosulfonyl)-3-methyl-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1c(C)n[nH]c1S(=O)(=O)Cl

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CCOC(=O)c1c(C)n(nH)c1S(=O)(=O)Cl

ETHYL3(CHLOROSULFONYL)5METHYL1HPYRAZOLE4CARBOXYLATE

1299471285

ETHYL5(CHLOROSULFONYL)3METHYL1HPYRAZOLE4CARBOXYLATE

ZINC81113220

ethyl3chlorosulfonyl5methyl1Hpyrazole4carboxylate

CCOC(=O)C1=C(NN=C1S(=O)(=O)Cl)C

InChI=1SC7H9ClN2O4Sc13147(11)54(2)9106(5)15(812)13h3H212H3(H910)


BBL000410
Synonyms: 3-(3-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: COc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

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COc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

3(3METHOXYPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(3METHOXYPHENYL)4OXOPHTHALAZINE1CARBOXYLICACID

ZINC109862

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI=1SC16H12N2O4c1221164510(911)1815(19)13832712(13)14(1718)16(20)21h29H1H3(H2021)


BBL000411
Synonyms: 3-(4-fluorophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Fc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Fc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

ZINC1399920

3(4FLUOROPHENYL)4KETOPHTHALAZINE1CARBOXYLICACID

3(4FLUOROPHENYL)4OXIDANYLIDENEPHTHALAZINE1CARBOXYLICACID

3(4FLUOROPHENYL)4OXO1PHTHALAZINECARBOXYLICACID

3(4FLUOROPHENYL)4OXO34DIHYDRO1PHTHALAZINECARBOXYLICACID

3(4FLUOROPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(4FLUOROPHENYL)4OXOPHTHALAZINE1CARBOXYLICACID

339021168

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)F)C(=O)O

InChI=1SC15H9FN2O3c1695710(869)1814(19)12421311(12)13(1718)15(20)21h18H(H2021)


BBL000412
Synonyms: 3-(3-chlorophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Clc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Clc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

3(3CHLOROPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

ZINC49452791

3(3chlorophenyl)4oxophthalazine1carboxylicacid

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC(=CC=C3)Cl)C(=O)O

InChI=1SC15H9ClN2O3c16943510(89)1814(19)12721611(12)13(1718)15(20)21h18H(H2021)


BBL000413
Synonyms: 3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: COc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

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COc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

ZINC109879

3(4METHOXYPHENYL)4OXO34DIHYDRO1PHTHALAZINECARBOXYLICACID

3(4METHOXYPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(4METHOXYPHENYL)4OXOPHTHALAZINE1CARBOXYLICACID

36710948

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI=1SC16H12N2O4c122118610(7911)1815(19)13532412(13)14(1718)16(20)21h29H1H3(H2021)


BBL000414
Synonyms: 3-(4-chlorophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Clc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Clc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

ZINC109845

3(4CHLOROPHENYL)4OXO34DIHYDRO1PHTHALAZINECARBOXYLICACID

3(4CHLOROPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(4CHLOROPHENYL)4OXOPHTHALAZINE1CARBOXYLICACID

86662159

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Cl)C(=O)O

InChI=1SC15H9ClN2O3c1695710(869)1814(19)12421311(12)13(1718)15(20)21h18H(H2021)


BBL000415
Synonyms: 3-(4-methylphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Cc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Cc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

ZINC49452788

1283521787

3(4METHYLPHENYL)4OXO34DIHYDRO1PHTHALAZINECARBOXYLICACID

3(4METHYLPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(4methylphenyl)4oxophthalazine1carboxylicacid

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI=1SC16H12N2O3c1106811(9710)1815(19)13532412(13)14(1718)16(20)21h29H1H3(H2021)


BBL000416
Synonyms: 3-(3-methylphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Cc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Cc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

MFCD15730031

ZINC000049452789

ZINC49452789

16015502

3(3METHYLPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(3methylphenyl)4oxophthalazine1carboxylicacid

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI=1SC16H12N2O3c11054611(910)1815(19)13832712(13)14(1718)16(20)21h29H1H3(H2021)


BBL000417
Synonyms: 2-chloro-3-(pyrrolidin-1-ylsulfonyl)pyridine
Smiles: Clc1ncccc1S(=O)(=O)N1CCCC1

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Clc1ncccc1S(=O)(=O)N1CCCC1

60597708

1((2CHLOROPYRIDIN3YL)SULPHONYL)PYRROLIDINE

2CHLORO3(PYRROLIDIN1YLSULFONYL)PYRIDINE

2CHLORO3(PYRROLIDIN1YLSULPHONYL)PYRIDINE

2CHLORO3(PYRROLIDINE1SULFONYL)PYRIDINE

PYRIDINE2CHLORO3(1PYRROLIDINYLSULFONYL)

ZINC15021093

2chloro3pyrrolidin1ylsulfonylpyridine

C1CCN(C1)S(=O)(=O)C2=C(N=CC=C2)Cl

InChI=1SC9H11ClN2O2Sc1098(435119)15(1314)12612712h35H1267H2


BBL000418
Synonyms: 3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxylicacid
Smiles: OC(=O)c1sc2c(c1n1cccc1)cccn2

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OC(=O)c1sc2c(c1n1cccc1)cccn2

ZINC45795967

1242874276

3(1HPYRROL1YL)THIENO(23B)PYRIDINE2CARBOXYLICACID

3pyrrol1ylthieno(23b)pyridine2carboxylicacid

C1=CN(C=C1)C2=C(SC3=C2C=CC=N3)C(=O)O

InChI=1SC12H8N2O2Sc1512(16)109(14612714)84351311(8)1710h17H(H1516)


BBL000419
Synonyms: 6-chloropyridine-3-sulfonylchloride
Smiles: Clc1ccc(cn1)S(=O)(=O)Cl

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Clc1ccc(cn1)S(=O)(=O)Cl

ZINC59796816

2CHLORO5CHLOROSULFONYLPYRIDINE

2CHLORO5PYRIDINESULFONYLCHLORIDE

2CHLORO5PYRIDINESULPHONYLCHLORIDE

2CHLOROPYRIDIN5SULFONYLCHLORIDE

2CHLOROPYRIDINE5SULFONYLCHLORIDE

2CHLOROPYRIDINE5SULPHONYLCHLORIDE

3PYRIDINESULFONYLCHLORIDE6CHLORO

6684395

6CHLORANYLPYRIDINE3SULFONYLCHLORIDE

6CHLORO3PYRIDINESULFONYLCHLORIDE

6CHLORO3PYRIDYLSULFONYLCHLORIDE

6CHLOROPYRIDIN3SULFONYLCHLORIDE

6CHLOROPYRIDIN3YLSULFONYLCHLORIDE

6CHLOROPYRIDINE3SULFONYLCHLORIDE

6CHLOROPYRIDINE3YLSULFONYLCHLORIDE

CHLORO(6CHLORO(3PYRIDYL))SULFONE


BBL000420
Synonyms: 2-chloropyridine-3-sulfonylchloride
Smiles: Clc1ncccc1S(=O)(=O)Cl

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Clc1ncccc1S(=O)(=O)Cl

ZINC59796864

2CHLORANYLPYRIDINE3SULFONYLCHLORIDE

2CHLORO3(CHLOROSULPHONYL)PYRIDINE

2CHLORO3PYRIDINESULFONICACIDCHLORIDE

2CHLORO3PYRIDINESULFONYLCHLORIDE

2CHLOROPYRIDINE3SULFONYLCHLORI

2CHLOROPYRIDINE3SULFONYLCHLORIDE

2CHLOROPYRIDINE3SULPHONYLCHLORIDE

3PYRIDINESULFONYLCHLORIDE2CHLORO

6684066

CHLORO(2CHLORO(3PYRIDYL))SULFONE


BBL000421
Synonyms: methyl3-sulfamoylthiophene-2-carboxylate
Smiles: COC(=O)c1sccc1S(=O)(=O)Cl

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COC(=O)c1sccc1S(=O)(=O)Cl

methyl3sulfamoylthiophene2carboxylate

METHYLCHLOROSULFONYLTHIOPHENECARBOXYLATE

MFCD00068160

ZINC000095707830

ZINC95707830

2(METHOXYCARBONYL)3THIOPHENESULFONYLCHLORIDE

2(METHOXYCARBONYL)THIOPHENE3SULFONYLCHLORIDE

2(METHOXYCARBONYL)THIOPHENE3SULPHONYLCHLORIDE

2(METHOXYLCARBONYL)THIOPHENE3SULFONYLCHLORIDE

2CARBOMETHOXY3THIOPHENESULFONYLCHLORIDE

2CARBOMETHOXY3THIOPHENESULFONYLCHLORIDE95

2CARBOMETHOXYTHIOPHENE3SULFONYLCHLORIDE

2METHOXYCARBONYL3THIOPHENESULFONYLCHLORIDE

2METHOXYCARBONYLTHIOPHENE3SULFONYLCHLORIDE

3(CHLOROSULFONYL)2THIOPHENECARBOXYLICACIDMETHYLESTER

3(CHLOROSULFONYL)THIOPHENE2CARBOXYLICACIDMETHYLESTER

3CHLOROSULFONYL2THIOPHENECARBOXYLICACIDMETHYLESTER

3CHLOROSULFONYLTHIOPHENE2CARBOXYLICACIDMETHYLESTER

3CHLOROSULPHONYLTHIOPHENE2CARBOXYLICACIDMETHYLESTER

59337927

2(CARBOMETHOXY)THIOPHENE3SULFONYLCHLORIDE

2(CARBOMETHOXY)THIOPHENE3SULPHONYLCHLORIDE

METHYL3CHLOROSULFONYLTHIOPHENE2CARBOXYLATE3CHLOROSULFONYLTHIOPHENE2CARBOXYLICACIDMETHYLESTER2(METHOXYCARBONYL)3THIOPHENESULFONYLCHLORIDE

METHYL3CHLOROSULPHONYLTHIOPHENECARBOXYLATE

METHYL3(CHLOROSULFONYL)2THIOPHENECARBOXYLATE

METHYL3(CHLOROSULFONYL)THIOPHENE2CARBOXYLATE

METHYL3(CHLOROSULPHONYL)THIOPHENE2CARBOXYLATE

METHYL3CHLOROSULFONYL2THIOPHENECARBOXYLATE

METHYL3CHLOROSULFONYLTHIOPHENE2CARBOXYLATE

COC(=O)C1=C(C=CS1)S(=O)(=O)Cl

InChI=1SC6H5ClO4S2c1116(8)54(23125)13(79)10h23H1H3


BBL000422
Synonyms: quinazolin-4(3H)-one
Smiles: O=c1[nH]cnc2c1cccc2

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O=c1(nH)cnc2c1cccc2

QUINAZOLIDIN4ONE

14DIHYDROQUINAZOLIN4ONE

1HQUINAZOLIN4ONE

QUINAZOLIN4(1H)ONE

QUINAZOLIN4(3H)ONE

QUINAZOLIN4OL

QUINAZOLIN4ONE

QUINAZOLINE4(3H)ONE

QUINAZOLINE4HYDROXY

QUINAZOLONE4

ZINC17970819

34DIHYDROQUINAZOLIN4ONE

3HQUINAZOLIN4ONE

3HYDRO4QUINAZOLINONE

3HYDROQUINAZOLIN4ONE

4(1H)QUINAZOLINONE

4(3H)QUINAZOLINONE

4(3H)QUINAZOLINONE(9CI)

4(3H)QUINAZOLINONE2CHLORO3(24DICHLOROPHENYL)6FLUORO

4(3H)QUINAZOLONE

491361

4HQUINAZOLIN4ONE

4HYDROXYQUINAZOLINE

4HYDROXYQUINAZOLINE95

4OXO34DIHYDROQUINAZOLINE

4OXOQUINAZOLINE

4QUINAZOLINOL

4QUINAZOLINOL3AMINO6CHLORO4(2CHLOROPHENYL)34DIHYDRO2METHYL

4QUINAZOLINONE

4QUINAZOLONE

C1=CC=C2C(=C1)C(=O)N=CN2

InChI=1SC8H6N2Oc118631247(6)95108h15H(H91011)


BBL000423
Synonyms: 4-phenyl-1,2-oxazol-5-amine
Smiles: Nc1oncc1c1ccccc1

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Nc1oncc1c1ccccc1

ZINC03844483

ZINC3844483

4320836

4PHENYL12OXAZOL5AMINE

4PHENYL5ISOXAZOLAMINE

4PHENYLISOXAZOL5AMINE

4PHENYLISOXAZOL5YLAMINE

5AMINO4PHENYLISOXAZOLE

C1=CC=C(C=C1)C2=C(ON=C2)N

InChI=1SC9H8N2Oc1098(611129)7421357h16H10H2


BBL000424
Synonyms: 3-propylquinazoline-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)[nH]c2c(c1=O)cccc2

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CCCn1c(=O)(nH)c2c(c1=O)cccc2

ZINC15424715

20297192

3(PROPYL)24(1H3H)QUINAZOLINEDIONE

3NPROPYLQUINAZOLINE24(1H3H)DIONE

3PROPYL13DIHYDROQUINAZOLINE24DIONE

3PROPYL1HQUINAZOLINE24DIONE

3PROPYL1HQUINAZOLINE24QUINONE

3PROPYL24(1H3H)QUINAZOLINEDIONE

3PROPYLQUINAZOLINE24(1H3H)DIONE

CCCN1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC11H12N2O2c1271310(14)853469(8)1211(13)15h36H27H21H3(H1215)


BBL000425
Synonyms: 3-(butan-2-yl)quinazoline-2,4(1H,3H)-dione
Smiles: CCC(n1c(=O)[nH]c2c(c1=O)cccc2)C

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CCC(n1c(=O)(nH)c2c(c1=O)cccc2)C

3(1METHYLPROPYL)1HQUINAZOLINE24DIONE

3(BUTAN2YL)QUINAZOLINE24(1H3H)DIONE

3SECBUTYL1HQUINAZOLINE24DIONE

3SECBUTYL1HQUINAZOLINE24QUINONE

3SECBUTYLQUINAZOLINE24(1H3H)DIONE

5081889

3butan2yl1Hquinazoline24dione

CCC(C)N1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC12H14N2O2c138(2)1411(15)9645710(9)1312(14)16h48H3H212H3(H1316)


BBL000426
Synonyms: 3-(furan-2-ylmethyl)quinazoline-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2ccccc2c(=O)n1Cc1ccco1

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O=c1(nH)c2ccccc2c(=O)n1Cc1ccco1

ZINC15424680

24(1H3H)QUINAZOLINEDIONE3(2FURANYLMETHYL)

3(2FURANYLMETHYL)1HQUINAZOLINE24DIONE

3(2FURFURYL)1HQUINAZOLINE24QUINONE

3(FURAN2YLMETHYL)1HQUINAZOLINE24DIONE

3(FURAN2YLMETHYL)QUINAZOLINE24(1H3H)DIONE

3FURAN2YLMETHYL1HQUINAZOLINE24DIONE

3FURFURYLQUINAZOLINE24(1H3H)DIONE

436855786

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CC3=CC=CO3

InChI=1SC13H10N2O3c161210512611(10)1413(17)15(12)89437189h17H8H2(H1417)


BBL000427
Synonyms: 3-(prop-2-en-1-yl)quinazoline-2,4(1H,3H)-dione
Smiles: C=CCn1c(=O)[nH]c2c(c1=O)cccc2

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C=CCn1c(=O)(nH)c2c(c1=O)cccc2

ZINC21657981

10341863

24(1H3H)QUINAZOLINEDIONE3(2PROPENYL)

2HYDROXY3ALLYL4OXO34DEHYDROQUINAZOLINE

3(PROP2EN1YL)QUINAZOLINE24(1H3H)DIONE

3ALLYL1HQUINAZOLINE24DIONE

3ALLYL24(1H3H)QUINAZOLINEDIONE

3ALLYL2HYDROXY4(3H)QUINAZOLINONE

3ALLYLQUINAZOLINE24(1H3H)DIONE

3PROP2ENYL1HQUINAZOLINE24DIONE

C=CCN1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC11H10N2O2c1271310(14)853469(8)1211(13)15h26H17H2(H1215)


BBL000428
Synonyms: 9-fluoro[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Fc1cccc2c1c1nc[nH]c(=O)c1s2

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Fc1cccc2c1c1nc(nH)c(=O)c1s2

ZINC00260771

ZINC260771

503423798

9FLUORO(1)BENZOTHIENO(32D)PYRIMIDIN4(3H)ONE

9FLUORO1H(1)BENZOTHIOLO(32D)PYRIMIDIN4ONE

9FLUORO3HBENZO(45)THIENO(32D)PYRIMIDIN4ONE

C1=CC(=C2C(=C1)SC3=C2NC=NC3=O)F

InChI=1SC10H5FN2OSc11521367(5)89(156)10(14)134128h14H(H121314)


BBL000429
Synonyms: 3-(propan-2-yl)quinazoline-2,4(1H,3H)-dione
Smiles: CC(n1c(=O)[nH]c2c(c1=O)cccc2)C

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CC(n1c(=O)(nH)c2c(c1=O)cccc2)C

ZINC03851502

ZINC3851502

24(1H3H)QUINAZOLINEDIONE3(1METHYLETHYL)

3(PROPAN2YL)QUINAZOLINE24(1H3H)DIONE

3ISOPROPYL1HQUINAZOLINE24DIONE

3PROPAN2YL1HQUINAZOLINE24DIONE

5943919

CC(C)N1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC11H12N2O2c17(2)1310(14)853469(8)1211(13)15h37H12H3(H1215)


BBL000430
Synonyms: 3-(3,5-dimethylphenyl)quinazoline-2,4(1H,3H)-dione
Smiles: Cc1cc(C)cc(c1)n1c(=O)[nH]c2c(c1=O)cccc2

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Cc1cc(C)cc(c1)n1c(=O)(nH)c2c(c1=O)cccc2

ZINC15424637

3(35DIMETHYLPHENYL)1HQUINAZOLINE24DIONE

3(35DIMETHYLPHENYL)QUINAZOLINE24(1H3H)DIONE

499132773

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3NC2=O)C

InChI=1SC16H14N2O2c110711(2)912(810)1815(19)13534614(13)1716(18)20h39H12H3(H1720)


BBL000431
Synonyms: 1-(7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1ncnc2c1sc1c2c(C)cc(n1)C

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OC(=O)C1CCN(CC1)c1ncnc2c1sc1c2c(C)cc(n1)C

1(79dimethylpyrido(3245)thieno(32d)pyrimidin4yl)piperidine4carboxylicacid

1232767495

ZINC40478772

1(79dimethylpyrido(23)thieno(24d)pyrimidin4yl)piperidine4carboxylicacid

CC1=CC(=NC2=C1C3=C(S2)C(=NC=N3)N4CCC(CC4)C(=O)O)C

InChI=1SC17H18N4O2Sc19710(2)201612(9)1314(2416)15(1981813)215311(4621)17(22)23h7811H36H212H3(H2223)


BBL000432
Synonyms: 3-(2,5-difluorophenyl)quinazoline-2,4(1H,3H)-dione
Smiles: Fc1ccc(c(c1)n1c(=O)[nH]c2c(c1=O)cccc2)F

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Fc1ccc(c(c1)n1c(=O)(nH)c2c(c1=O)cccc2)F

ZINC44841928

3(25DIFLUOROPHENYL)1HQUINAZOLINE24DIONE

3(25DIFLUOROPHENYL)QUINAZOLINE24(1H3H)DIONE


BBL000433
Synonyms: 3-(3,4-dimethylphenyl)quinazoline-2,4(1H,3H)-dione
Smiles: Cc1cc(ccc1C)n1c(=O)[nH]c2c(c1=O)cccc2

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Cc1cc(ccc1C)n1c(=O)(nH)c2c(c1=O)cccc2

ZINC15424639

3(34DIMETHYLPHENYL)1HQUINAZOLINE24DIONE

3(34DIMETHYLPHENYL)QUINAZOLINE24(1H3H)DIONE

67117004

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=O)C

InChI=1SC16H14N2O2c1107812(911(10)2)1815(19)13534614(13)1716(18)20h39H12H3(H1720)


BBL000434
Synonyms: 3-(2-methylpropyl)quinazoline-2,4(1H,3H)-dione
Smiles: CC(Cn1c(=O)[nH]c2c(c1=O)cccc2)C

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CC(Cn1c(=O)(nH)c2c(c1=O)cccc2)C

ZINC15829133

25329242

3(2METHYLPROPYL)QUINAZOLINE24(1H3H)DIONE

3ISOBUTYL1HQUINAZOLINE24DIONE

3(2methylpropyl)1Hquinazoline24dione

CC(C)CN1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC12H14N2O2c18(2)71411(15)9534610(9)1312(14)16h368H7H212H3(H1316)


BBL000435
Synonyms: 1-(4-oxo-3,4-dihydroquinazolin-2-yl)piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1nc2ccccc2c(=O)[nH]1

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OC(=O)C1CCN(CC1)c1nc2ccccc2c(=O)(nH)1

ZINC19689739

1(4OXO34DIHYDROQUINAZOLIN2YL)PIPERIDINE4CARBOXYLICACID

1082478167

1(4oxo1Hquinazolin2yl)piperidine4carboxylicacid

C1CN(CCC1C(=O)O)C2=NC(=O)C3=CC=CC=C3N2

InChI=1SC14H15N3O3c181210312411(10)1514(1612)17759(6817)13(19)20h149H58H2(H1920)(H151618)


BBL000436
Synonyms: 2-methylquinazolin-4(3H)-one
Smiles: Cc1nc2ccccc2c(=O)[nH]1

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Cc1nc2ccccc2c(=O)(nH)1

132305216

2METHYL14DIHYDROQUINAZOLIN4ONE

ZINC08793749

ZINC8793749

2METHYL1HQUINAZOLIN4ONE

2METHYL3HQUINAZOLIN4ONE

2METHYL3HYDROQUINAZOLIN4ONE

2METHYL4(3H)QUINAZOLINONE

2METHYL4OXO34DIHYDROQUINAZOLINE

2METHYL4QUINAZOLINOL

2METHYL4QUINAZOLINOLHYDROCHLORIDE

2METHYL4QUINAZOLINONE

2METHYLCHINAZOLINONE(4)

2METHYLQUINAZOLIN4(1H)ONE

2METHYLQUINAZOLIN4(3H)ONE

2METHYLQUINAZOLIN4OL

2METHYLQUINAZOLIN4ONE

2METHYLQUINAZOLONE

4(1H)QUINAZOLINONE2METHYL

4(1H)QUINAZOLINONE2METHYL(7CI9CI)

4(3H)QUINAZOLINONE2METHYL

4HYDROXY2METHYLQUINAZOLINE

4QUINAZOLINOL2METHYL

4QUINAZOLINOL2METHYL(8CI)

CC1=NC(=O)C2=CC=CC=C2N1

InChI=1SC9H8N2Oc1610853247(8)9(12)116h25H1H3(H101112)


BBL000437
Synonyms: 3-(3-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: Clc1cccc(c1)Cn1c(=S)[nH]c2c(c1=O)cccc2

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Clc1cccc(c1)Cn1c(=S)(nH)c2c(c1=O)cccc2

ZINC17030879

3((3CHLOROPHENYL)METHYL)2SULFANYLIDENE1HQUINAZOLIN4ONE

3(3CHLOROBENZYL)2SULFANYLQUINAZOLIN4(3H)ONE

3(3CHLOROBENZYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

35976977

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC(=CC=C3)Cl

InChI=1SC15H11ClN2OSc161153410(811)91814(19)12612713(12)1715(18)20h18H9H2(H1720)


BBL000438
Synonyms: 3-(2-phenylethyl)quinazoline-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2ccccc2c(=O)n1CCc1ccccc1

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O=c1(nH)c2ccccc2c(=O)n1CCc1ccccc1

ZINC15424736

3(2PHENYLETHYL)13DIHYDROQUINAZOLINE24DIONE

3(2PHENYLETHYL)QUINAZOLINE24(1H3H)DIONE

3PHENETHYL1HQUINAZOLINE24DIONE

3PHENETHYLQUINAZOLINE24(1H3H)DIONE

4059716

3(2phenylethyl)1Hquinazoline24dione

C1=CC=C(C=C1)CCN2C(=O)C3=CC=CC=C3NC2=O

InChI=1SC16H14N2O2c191513845914(13)1716(20)18(15)1110126213712h19H1011H2(H1720)


BBL000439
Synonyms: 2-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)c1nc2ccccc2c(=O)[nH]1

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Cc1ccc(cc1)c1nc2ccccc2c(=O)(nH)1

ZINC08714038

ZINC8714038

18818412

2(4METHYLPHENYL)1HQUINAZOLIN4ONE

2(4METHYLPHENYL)34DIHYDROQUINAZOLIN4ONE

2(4METHYLPHENYL)4(3H)QUINAZOLINONE

2(4METHYLPHENYL)QUINAZOLIN4(3H)ONE

2(4METHYLPHENYL)QUINAZOLIN4OL

2(PTOLYL)QUINAZOLIN4(3H)ONE

2PTOLYL3HQUINAZOLIN4ONE

2PTOLYLQUINAZOLIN4(3H)ONE

CC1=CC=C(C=C1)C2=NC(=O)C3=CC=CC=C3N2

InChI=1SC15H12N2Oc1106811(9710)141613532412(13)15(18)1714h29H1H3(H161718)


BBL000440
Synonyms: 6-(4-ethoxyphenyl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1)c1ccc(c(=S)[nH]1)C#N

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CCOc1ccc(cc1)c1ccc(c(=S)(nH)1)C#N

ZINC49846097

1255784236

6(4ETHOXYPHENYL)2THIOXO12DIHYDROPYRIDINE3CARBONITRILE

6(4ethoxyphenyl)2sulfanylidene1Hpyridine3carbonitrile

CCOC1=CC=C(C=C1)C2=CC=C(C(=S)N2)C#N

InChI=1SC14H12N2OSc1217126310(4712)138511(915)14(18)1613h38H2H21H3(H1618)


BBL000441
Synonyms: 6-chloroquinazolin-4(3H)-one
Smiles: Clc1ccc2c(c1)c(=O)[nH]cn2

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Clc1ccc2c(c1)c(=O)(nH)cn2

ZINC14982402

16064145

4(3H)QUINAZOLINONE6CHLORO

6CHLORO1HQUINAZOLIN4ONE

6CHLORO34DIHYDROQUINAZOLIN4ONE

6CHLORO3HQUINAZOLIN4ONE

6CHLORO3HYDROQUINAZOLIN4ONE

6CHLORO4(1H)QUINAZOLINONE

6CHLORO4HYDROXYQUINAZOLINE

6CHLORO4QUINAZOLINONE

6CHLORO4QUINAZOLONE

6CHLOROQUINAZOLIN4(1H)ONE

6CHLOROQUINAZOLIN4(3H)ONE

6CHLOROQUINAZOLIN4OL

6CHLOROQUINAZOLIN4ONE

C1=CC2=C(C=C1Cl)C(=O)N=CN2

InChI=1SC8H5ClN2Oc951276(35)8(12)114107h14H(H101112)


BBL000442
Synonyms: 2,4-dichloro-6,7-dimethoxyquinazoline
Smiles: COc1cc2nc(Cl)nc(c2cc1OC)Cl

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COc1cc2nc(Cl)nc(c2cc1OC)Cl

QUINAZOLINE24DICHLORO67DIMETHOXY

ZINC02028663

ZINC2028663

24DICHLORO67DIMETHOXYQUINAZOLINE

24DICHLORO67DIMETHOXYQUINOAZOLINE

27631294

2CHLORO67DIMETHOXYQUINAZOLIN4YLCHLORIDE

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)Cl)OC

InChI=1SC10H8Cl2N2O2c1157356(48(7)162)1310(12)149(5)11h34H12H3


BBL000443
Synonyms: 3-(2-methylpropyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: CC(Cn1c(=S)[nH]c2c(c1=O)cccc2)C

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CC(Cn1c(=S)(nH)c2c(c1=O)cccc2)C

ISOBUTYLTHIOXODIHYDROQUINAZOLINONE

ZINC03245255

ZINC3245255

117038398

23DIHYDRO3(2METHYLPROP1YL)2THIOXOQUINAZOLIN4(1H)ONE

3(2METHYLPROPYL)2SULFANYLIDENE1HQUINAZOLIN4ONE

3(2METHYLPROPYL)2SULFANYLQUINAZOLIN4(3H)ONE

3(2METHYLPROPYL)2THIOXO13DIHYDROQUINAZOLIN4ONE

3(2METHYLPROPYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

3ISOBUTYL2MERCAPTO3HQUINAZOLIN4ONE

3ISOBUTYL2MERCAPTO4(3H)QUINAZOLINONE

3ISOBUTYL2THIOXO23DIHYDRO4(1H)QUINAZOLINONE

3ISOBUTYL2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

CC(C)CN1C(=O)C2=CC=CC=C2NC1=S

InChI=1SC12H14N2OSc18(2)71411(15)9534610(9)1312(14)16h368H7H212H3(H1316)


BBL000444
Synonyms: 3-(4-fluorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: Fc1ccc(cc1)Cn1c(=S)[nH]c2c(c1=O)cccc2

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Fc1ccc(cc1)Cn1c(=S)(nH)c2c(c1=O)cccc2

ZINC100071917

3((4FLUOROPHENYL)METHYL)2SULFANYL34DIHYDROQUINAZOLIN4ONE

3((4FLUOROPHENYL)METHYL)2SULFANYLIDENE1HQUINAZOLIN4ONE

3(4FLUOROBENZYL)2MERCAPTOQUINAZOLIN4(3H)ONE

3(4FLUOROBENZYL)2SULFANYLQUINAZOLIN4(3H)ONE

3(4FLUOROBENZYL)2THIOXO23DIHYDRO4(1H)QUINAZOLINONE

3(4FLUOROBENZYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

431980108

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)F

InChI=1SC15H11FN2OSc16117510(6811)91814(19)12312413(12)1715(18)20h18H9H2(H1720)


BBL000445
Synonyms: 3-(3-methylbutyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: CC(CCn1c(=S)[nH]c2c(c1=O)cccc2)C

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CC(CCn1c(=S)(nH)c2c(c1=O)cccc2)C

MFCD03141136

ZINC000002656619

ZINC02656619

ZINC2656619

2MERCAPTO3(3METHYLBUTYL)QUINAZOLIN4(3H)ONE

3(3METHYLBUTYL)2SULFANYL34DIHYDROQUINAZOLIN4ONE

3(3METHYLBUTYL)2SULFANYL3HYDROQUINAZOLIN4ONE

3(3METHYLBUTYL)2SULFANYLIDENE1HQUINAZOLIN4ONE

3(3METHYLBUTYL)2SULFANYLQUINAZOLIN4(3H)ONE

3(3METHYLBUTYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

431931554

CC(C)CCN1C(=O)C2=CC=CC=C2NC1=S

InChI=1SC13H16N2OSc19(2)781512(16)10534611(10)1413(15)17h369H78H212H3(H1417)


BBL000446
Synonyms: 4-amino-5-[2-(methylsulfanyl)ethyl]-4H-1,2,4-triazole-3-thiol
Smiles: CSCCc1nnc(n1N)S

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CSCCc1nnc(n1N)S

MFCD03030239

ZINC000032919375

ZINC32919375

1172536387

4AMINO5(2(METHYLSULFANYL)ETHYL)4H124TRIAZOLE3THIOL

4amino3(2methylsulfanylethyl)1H124triazole5thione

CSCCC1=NNC(=S)N1N

InChI=1SC5H10N4S2c111324785(10)9(4)6h236H21H3(H810)


BBL000447
Synonyms: 3-[2-(thiophen-2-yl)ethyl]-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: S=c1[nH]c2ccccc2c(=O)n1CCc1cccs1

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S=c1(nH)c2ccccc2c(=O)n1CCc1cccs1

ZINC07046598

ZINC7046598

1007797649

2SULFANYL3(2(THIOPHEN2YL)ETHYL)QUINAZOLIN4(3H)ONE

3(2(THIOPHEN2YL)ETHYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

2sulfanylidene3(2thiophen2ylethyl)1Hquinazolin4one

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC3=CC=CS3

InChI=1SC14H12N2OS2c171311512612(11)1514(18)16(13)87104391910h169H78H2(H1518)


BBL000448
Synonyms: 3-(4-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: Clc1ccc(cc1)Cn1c(=S)[nH]c2c(c1=O)cccc2

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Clc1ccc(cc1)Cn1c(=S)(nH)c2c(c1=O)cccc2

MFCD02650888

ZINC000100071927

ZINC100071927

3((4CHLOROPHENYL)METHYL)2SULFANYL34DIHYDROQUINAZOLIN4ONE

3((4CHLOROPHENYL)METHYL)2SULFANYL3HYDROQUINAZOLIN4ONE

3((4CHLOROPHENYL)METHYL)2SULFANYLIDENE1HQUINAZOLIN4ONE

3(4CHLOROBENZYL)2MERCAPTO3HQUINAZOLIN4ONE

3(4CHLOROBENZYL)2SULFANYLQUINAZOLIN4(3H)ONE

3(4CHLOROBENZYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

35976999

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)Cl

InChI=1SC15H11ClN2OSc16117510(6811)91814(19)12312413(12)1715(18)20h18H9H2(H1720)


BBL000449
Synonyms: 3-amino-6-(1,3-benzodioxol-5-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: NC(=O)c1sc2c(c1N)ccc(n2)c1ccc2c(c1)OCO2

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NC(=O)c1sc2c(c1N)ccc(n2)c1ccc2c(c1)OCO2

ZINC19957020

3AMINO6(13BENZODIOXOL5YL)THIENO(23B)PYRIDINE2CARBOXAMIDE

3AMINO6BENZO(13)DIOXOL5YLTHIENO(23B)PYRIDINE2CARBOXYLICACIDAMIDE

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(C=C3)C(=C(S4)C(=O)N)N

InChI=1SC15H11N3O3Sc16128239(1815(8)2213(12)14(17)19)7141011(57)2162010h15H616H2(H21719)


BBL000450
Synonyms: 2-(nitroamino)-6-phenylpyrimidin-4(3H)-one
Smiles: [O-][N+](=O)Nc1nc(cc(=O)[nH]1)c1ccccc1

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(O)(N+)(=O)Nc1nc(cc(=O)(nH)1)c1ccccc1

2(NITROAMINO)6PHENYLPYRIMIDIN4(3H)ONE

2(NITROAMINO)6PHENYLPYRIMIDIN4OL

4(3H)PYRIMIDINONE2(NITROAMINO)6PHENYL

56741969

N(4OXO6PHENYL1HPYRIMIDIN2YL)NITRAMIDE

ZINC16971316

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)N(N+)(=O)(O)

InChI=1SC10H8N4O3c15968(7421357)1110(129)1314(16)17h16H(H211121315)


BBL000451
Synonyms: methyl2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)benzoate
Smiles: COC(=O)c1ccccc1n1c(=O)[nH]c2c(c1=O)cccc2

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COC(=O)c1ccccc1n1c(=O)(nH)c2c(c1=O)cccc2

13905970

METHYL2(24DIOXO14DIHYDROQUINAZOLIN3(2H)YL)BENZOATE

ZINC57352264

methyl2(24dioxo1Hquinazolin3yl)benzoate

COC(=O)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3NC2=O

InChI=1SC16H12N2O4c12215(20)11735913(11)1814(19)10624812(10)1716(18)21h29H1H3(H1721)


BBL000452
Synonyms: 9-chloro[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Clc1cccc2c1c1nc[nH]c(=O)c1s2

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Clc1cccc2c1c1nc(nH)c(=O)c1s2

ZINC57352398

9CHLORO(1)BENZOTHIENO(32D)PYRIMIDIN4(3H)ONE


BBL000453
Synonyms: 3-(2,5-dimethylbenzyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(c(c1)Cn1cnc2c(c1=O)cccc2)C

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Cc1ccc(c(c1)Cn1cnc2c(c1=O)cccc2)C

ZINC06838076

ZINC6838076

3((25DIMETHYLPHENYL)METHYL)QUINAZOLIN4ONE

3(25DIMETHYLBENZYL)QUINAZOLIN4(3H)ONE

849898426

CC1=CC(=C(C=C1)C)CN2C=NC3=CC=CC=C3C2=O

InChI=1SC17H16N2Oc1127813(2)14(912)1019111816643515(16)17(19)20h3911H10H212H3


BBL000454
Synonyms: 2-cyanoethanethioamide
Smiles: NC(=S)CC#N

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NC(=S)CC#N

ZINC05112695

ZINC5112695

(CYANO)THIOACETAMIDE

2CYANOETHANETHIOAMIDE

2CYANOTHIOACETAMIDE

3AMINO3THIOXOPROPANENITRILE

7357702

ALPHACYANOTHIOACETAMIDE

CYANOACETOTHIOAMIDE

CYANOTHIOACETAMIDE

ETHANETHIOAMIDE2CYANO

C(C#N)C(=S)N

InChI=1SC3H4N2Sc4213(5)6h1H2(H256)


BBL000455
Synonyms: 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1cc(C)c2c(n1)sc(c2N)C(=O)N

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Cc1cc(C)c2c(n1)sc(c2N)C(=O)N

ZINC00045266

ZINC45266

3AMINO46DIMETHYLTHIENO(23B)PRIDINE2CARBOXYLICACIDAMIDE

3AMINO46DIMETHYLTHIENO(23B)PYRIDINE2CARBOXAMIDE

3AMINO46DIMETHYLTHIENO(23B)PYRIDINE2CARBOXYLICACIDAMIDE

3AMINO46DIMETHYLTHIOPHENO(23B)PYRIDINE2CARBOXAMIDE

67795420

CC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)C

InChI=1SC10H11N3OSc1435(2)13106(4)7(11)8(1510)9(12)14h3H11H212H3(H21214)


BBL000456
Synonyms: (4-oxoquinazolin-3(4H)-yl)aceticacid
Smiles: OC(=O)Cn1cnc2c(c1=O)cccc2

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OC(=O)Cn1cnc2c(c1=O)cccc2

ZINC141049

(4OXO3(4H)QUINAZOLINYL)ACETICACID

(4OXO4HQUINAZOLIN3YL)ACETICACID

(4OXOQUINAZOLIN3(4H)YL)ACETICACID

(4OXOQUINAZOLIN3YL)ACETICACID

14663537

2(4OXO34DIHYDROQUINAZOLIN3YL)ACETICACID

2(4OXO3HYDROQUINAZOLIN3YL)ACETICACID

2(4OXOQUINAZOLIN3(4H)YL)ACETICACID

2(4OXOQUINAZOLIN3YL)ACETICACID

3(4H)QUINAZOLINEACETICACID4OXO

4OXOQUINAZOLINE3(4H)ACETICACID

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)O

InChI=1SC10H8N2O3c139(14)512611842137(8)10(12)15h146H5H2(H1314)


BBL000457
Synonyms: 7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Cc1cc(C)c2c(n1)sc1c2nc[nH]c1=O

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Cc1cc(C)c2c(n1)sc1c2nc(nH)c1=O

79dimethylpyrido(3245)thieno(32d)pyrimidin4(3H)one

24DIMETHYL9THIA157TRIAZAFLUOREN8OL

55023353

ZINC08739438

ZINC8739438

79dimethyl1Hpyrido(23)thieno(24d)pyrimidin4one

CC1=CC(=NC2=C1C3=C(S2)C(=O)N=CN3)C

InChI=1SC11H9N3OSc1536(2)14117(5)89(1611)10(15)134128h34H12H3(H121315)


BBL000458
Synonyms: 6-(thiophen-2-yl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1ccc([nH]c1=S)c1cccs1

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N#Cc1ccc((nH)c1=S)c1cccs1

ZINC00039962

ZINC39962

190579921

2MERCAPTO6(2THIENYL)PYRIDINE3CARBONITRILE

2SULFANYL6(2THIENYL)PYRIDINE3CARBONITRILE

2SULFANYL6(THIOPHEN2YL)PYRIDINE3CARBONITRILE

2SULFANYLIDENE6THIOPHEN2YL1HPYRIDINE3CARBONITRILE

3PYRIDINECARBONITRILE12DIHYDRO6(2THIENYL)2THIOXO

6(2THIENYL)2THIOXO12DIHYDRO3PYRIDINECARBONITRILE

6(2THIENYL)2THIOXOHYDROPYRIDINE3CARBONITRILE

6(THIOPHEN2YL)2THIOXO12DIHYDROPYRIDINE3CARBONITRILE

C1=CSC(=C1)C2=CC=C(C(=S)N2)C#N

InChI=1SC10H6N2S2c1167348(1210(7)13)9215149h15H(H1213)


BBL000459
Synonyms: 3-methyl-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: Cn1c(=S)[nH]c2c(c1=O)cccc2

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Cn1c(=S)(nH)c2c(c1=O)cccc2

ZINC03886416

ZINC3886416

1705095

2MERCAPTO3METHYL34DIHYDROQUINAZOLIN4ONE

2MERCAPTO3METHYL3HQUINAZOLIN4ONE

2MERCAPTO3METHYL4(3H)QUINAZOLINONE

2MERCAPTO3METHYLQUINAZOLIN4(3H)ONE

3METHYL2(1H)THIOXO4(3H)QUINAZOLINONE

3METHYL2(1H)THIOXOQUINAZOLINE4(3H)ONE

3METHYL2SULFANYL3HYDROQUINAZOLIN4ONE

3METHYL2SULFANYLIDENE1HQUINAZOLIN4ONE

3METHYL2SULFANYLQUINAZOLIN4(3H)ONE

3METHYL2SULFANYLQUINAZOLIN4ONE

3METHYL2THIOXO(1H)QUINAZOLIN4ONE

3METHYL2THIOXO1HQUINAZOLIN4ONE

3METHYL2THIOXO23DIHYDRO1HQUINAZOLIN4ONE

3METHYL2THIOXO23DIHYDRO4(1H)QUINAZOLINONE

3METHYL2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

4(1H)QUINAZOLINONE23DIHYDRO3METHYL2THIOXO

CN1C(=O)C2=CC=CC=C2NC1=S

InChI=1SC9H8N2OSc1118(12)642357(6)109(11)13h25H1H3(H1013)


BBL000460
Synonyms: 3-ethylquinazoline-2,4(1H,3H)-dione
Smiles: CCn1c(=O)[nH]c2c(c1=O)cccc2

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CCn1c(=O)(nH)c2c(c1=O)cccc2

ZINC12504790

2217267

3ETHYL13DIHYDROQUINAZOLINE24DIONE

3ETHYL1HQUINAZOLINE24DIONE

3ETHYL2HYDROXYQUINAZOLIN4(3H)ONE

3ETHYLQUINAZOLINE24(1H3H)DIONE

CCN1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC10H10N2O2c12129(13)753468(7)1110(12)14h36H2H21H3(H1114)


BBL000461
Synonyms: 3-(4-chlorobenzyl)quinazoline-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)Cn1c(=O)[nH]c2c(c1=O)cccc2

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Clc1ccc(cc1)Cn1c(=O)(nH)c2c(c1=O)cccc2

3(4CHLOROBENZYL)QUINAZOLINE24(1H3H)DIONE

909273865

ZINC15424730

3((4chlorophenyl)methyl)1Hquinazoline24dione

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CC3=CC=C(C=C3)Cl

InChI=1SC15H11ClN2O2c16117510(6811)91814(19)12312413(12)1715(18)20h18H9H2(H1720)


BBL000462
Synonyms: 3-propyl-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: CCCn1c(=S)[nH]c2c(c1=O)cccc2

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CCCn1c(=S)(nH)c2c(c1=O)cccc2

ZINC00619137

ZINC619137

2MERCAPTO3PROPYL3HQUINAZOLIN4ONE

2MERCAPTO3PROPYL4(3H)QUINAZOLINONE

3PROPYL2SULFANYL3HYDROQUINAZOLIN4ONE

3PROPYL2SULFANYLIDENE1HQUINAZOLIN4ONE

3PROPYL2SULFANYLQUINAZOLIN4(3H)ONE

3PROPYL2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

63586345

CCCN1C(=O)C2=CC=CC=C2NC1=S

InChI=1SC11H12N2OSc1271310(14)853469(8)1211(13)15h36H27H21H3(H1215)


BBL000463
Synonyms: methyl3-aminothieno[2,3-b]pyridine-2-carboxylate
Smiles: COC(=O)c1sc2c(c1N)cccn2

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COC(=O)c1sc2c(c1N)cccn2

111042898

2(METHOXYCARBONYL)THIENO(23B)PYRIDIN3AMINE

3AMINO2(METHOXYCARBONYL)THIENO(23B)PYRIDINE

3AMINOTHIENO(23B)PYRIDINE2CARBOXYLICACIDMETHYLESTER

METHYL3AMINOTHIENO(23B)PICOLINATE

METHYL3AMINOTHIENO(23B)PYRIDINE2CARBOXYLATE

METHYL3AMINOTHIOPHENO(23B)PYRIDINE2CARBOXYLATE

THIENO(23B)PYRIDINE2CARBOXYLICACID3AMINOMETHYLESTER

ZINC00149174

ZINC149174

COC(=O)C1=C(C2=C(S1)N=CC=C2)N

InChI=1SC9H8N2O2Sc1139(12)76(10)5324118(5)147h24H10H21H3


BBL000464
Synonyms: 3-(furan-2-ylmethyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: S=c1[nH]c2ccccc2c(=O)n1Cc1ccco1

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S=c1(nH)c2ccccc2c(=O)n1Cc1ccco1

ZINC00316464

ZINC316464

3(2FURYLMETHYL)2MERCAPTOQUINAZOLIN4(3H)ONE

3(2FURYLMETHYL)2SULFANYL3HYDROQUINAZOLIN4ONE

3(2FURYLMETHYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

3(FURAN2YLMETHYL)2SULFANYL34DIHYDROQUINAZOLIN4ONE

3(FURAN2YLMETHYL)2SULFANYLIDENE1HQUINAZOLIN4ONE

3(FURAN2YLMETHYL)2SULFANYLQUINAZOLIN4(3H)ONE

3(FURAN2YLMETHYL)2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE

3FURAN2YLMETHYL2MERCAPTO3HQUINAZOLIN4ONE

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=CO3

InChI=1SC13H10N2O2Sc161210512611(10)1413(18)15(12)89437179h17H8H2(H1418)


BBL000465
Synonyms: 3-(3-chlorobenzyl)quinazoline-2,4(1H,3H)-dione
Smiles: Clc1cccc(c1)Cn1c(=O)[nH]c2c(c1=O)cccc2

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Clc1cccc(c1)Cn1c(=O)(nH)c2c(c1=O)cccc2

ZINC42656822

1177806448

3(3CHLOROBENZYL)QUINAZOLINE24(1H3H)DIONE

3((3chlorophenyl)methyl)1Hquinazoline24dione

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CC3=CC(=CC=C3)Cl

InChI=1SC15H11ClN2O2c161153410(811)91814(19)12612713(12)1715(18)20h18H9H2(H1720)


BBL000466
Synonyms: 3-pentylquinazoline-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)[nH]c2c(c1=O)cccc2

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CCCCCn1c(=O)(nH)c2c(c1=O)cccc2

23905400

3PENTYLQUINAZOLINE24(1H3H)DIONE

ZINC15424718

3pentyl1Hquinazoline24dione

CCCCCN1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC13H16N2O2c123691512(16)10745811(10)1413(15)17h4578H2369H21H3(H1417)


BBL000467
Synonyms: 3-[2-(thiophen-2-yl)ethyl]quinazoline-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2ccccc2c(=O)n1CCc1cccs1

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O=c1(nH)c2ccccc2c(=O)n1CCc1cccs1

ZINC29874109

1252929795

3(2(THIOPHEN2YL)ETHYL)QUINAZOLINE24(1H3H)DIONE

3(2thiophen2ylethyl)1Hquinazoline24dione

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCC3=CC=CS3

InChI=1SC14H12N2O2Sc171311512612(11)1514(18)16(13)87104391910h169H78H2(H1518)


BBL000468
Synonyms: 3-(tetrahydrofuran-2-ylmethyl)quinazoline-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2ccccc2c(=O)n1CC1CCCO1

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24(1H3H)QUINAZOLINEDIONE3(TETRAHYDROFURFURYL)

3(OXOLAN2YLMETHYL)13DIHYDROQUINAZOLINE24DIONE

3(OXOLAN2YLMETHYL)1HQUINAZOLINE24DIONE

3(TETRAHYDROFURAN2YLMETHYL)QUINAZOLINE24(1H3H)DIONE


BBL000469
Synonyms: 3-(3-methylbutyl)quinazoline-2,4(1H,3H)-dione
Smiles: CC(CCn1c(=O)[nH]c2c(c1=O)cccc2)C

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CC(CCn1c(=O)(nH)c2c(c1=O)cccc2)C

3(3METHYLBUTYL)QUINAZOLINE24(1H3H)DIONE

945301280

ZINC15424797

3(3methylbutyl)1Hquinazoline24dione

CC(C)CCN1C(=O)C2=CC=CC=C2NC1=O

InChI=1SC13H16N2O2c19(2)781512(16)10534611(10)1413(15)17h369H78H212H3(H1417)


BBL000470
Synonyms: 3-(4-fluorobenzyl)quinazoline-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)[nH]c2c(c1=O)cccc2

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Fc1ccc(cc1)Cn1c(=O)(nH)c2c(c1=O)cccc2

3(4FLUOROBENZYL)QUINAZOLINE24(1H3H)DIONE

945368810

ZINC15424734

3((4fluorophenyl)methyl)1Hquinazoline24dione

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CC3=CC=C(C=C3)F

InChI=1SC15H11FN2O2c16117510(6811)91814(19)12312413(12)1715(18)20h18H9H2(H1720)


BBL000471
Synonyms: ethyl[(2-carbamoylphenyl)amino](oxo)acetate
Smiles: CCOC(=O)C(=O)Nc1ccccc1C(=O)N

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CCOC(=O)C(=O)Nc1ccccc1C(=O)N

ETHYL((2(AMINOCARBONYL)PHENYL)AMINO)(OXO)ACETATE

ETHYL((2CARBAMOYLPHENYL)AMINO)(OXO)ACETATE

ETHYL(2(AMINOCARBONYL)ANILINO)(OXO)ACETATE

ETHYL(N(2CARBAMOYLPHENYL)CARBAMOYL)FORMATE

ETHYL2((2CARBAMOYLPHENYL)AMINO)2OXOACETATE

ETHYL2(2CARBAMOYLANILINO)2OXOACETATE

54166948

ZINC01794273

ZINC1794273

CCOC(=O)C(=O)NC1=CC=CC=C1C(=O)N

InChI=1SC11H12N2O4c121711(16)10(15)13864357(8)9(12)14h36H2H21H3(H21214)(H1315)


BBL000472
Synonyms: [1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Smiles: O=c1[nH]cnc2c1sc1c2cccc1

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O=c1(nH)cnc2c1sc1c2cccc1

ZINC18217770

(1)BENZOTHIENO(32D)PYRIMIDIN4(3H)ONE

1H(1)BENZOTHIOLO(32D)PYRIMIDIN4ONE

36822089

3HBENZO(45)THIENO(32D)PYRIMIDIN4ONE

3HYDROBENZO(B)THIOPHENO(32D)PYRIMIDIN4ONE

BENZO(45)THIENO(32D)PYRIMIDIN4(3H)ONE

C1=CC=C2C(=C1)C3=C(S2)C(=O)N=CN3

InChI=1SC10H6N2OSc131098(1151210)631247(6)149h15H(H111213)


BBL000473
Synonyms: 1-methyl-3-thioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(=S)[nH]c(c2c1CCCC2)C

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N#Cc1c(=S)(nH)c(c2c1CCCC2)C

1methyl3thioxo235678hexahydroisoquinoline4carbonitrile

95546966

ZINC05537742

ZINC5537742

1methyl3sulfanylidene5678tetrahydro2Hisoquinoline4carbonitrile

CC1=C2CCCCC2=C(C(=S)N1)C#N

InChI=1SC11H12N2Sc17842359(8)10(612)11(14)137h25H21H3(H1314)


BBL000474
Synonyms: 6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Smiles: COc1cc2[nH]c(=O)[nH]c(=O)c2cc1OC

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COc1cc2(nH)c(=O)(nH)c(=O)c2cc1OC

QUINAZOLINE24DIOL67DIMETHOXY

ZINC00120622

ZINC120622

24(1H3H)QUINAZOLINEDIONE67DIMETHOXY

24DIHYDROXY67DIMETHOXYQUINAZOLINE

2888440

67DIMETHOXY(1H3H)24QUINAZOLINDIONE

67DIMETHOXY13DIHYDROQUINAZOLINE24DIONE

67DIMETHOXY1HQUINAZOLINE24DIONE

67DIMETHOXY24(1H3H)QUINAZOLINEDIONE

67DIMETHOXY24(1H3H)QUINAZOLINEDIONE97

67DIMETHOXY24DIHYDROXYQUINAZOLINE

67DIMETHOXY24QUINAZOLINEDIOL

67DIMETHOXY24QUINAZOLINEDIONE

67DIMETHOXYQUINAZOLINE24(1H3H)DIONE

67DIMETHOXYQUINAZOLINE24DIOL

67DIMETHOXYQUINAZOLINE24DIONE

COC1=C(C=C2C(=C1)C(=O)NC(=O)N2)OC

InChI=1SC10H10N2O4c1157356(48(7)162)1110(14)129(5)13h34H12H3(H211121314)


BBL000475
Synonyms: 4-amino-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Nn1c(COc2ccccc2)nnc1S

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Nn1c(COc2ccccc2)nnc1S

ZINC000003642080

ZINC3642080

MFCD00269275

24DIHYDRO4AMINO5(PHENOXYMETHYL)3H124TRIAZOLE3THIONE

3H124TRIAZOLE3THIONE24DIHYDRO4AMINO5(PHENOXYMETHYL)

3H124TRIAZOLE3THIONE4AMINO24DIHYDRO5(PHENOXYMETHYL)

3PHENOXYMETHYL4AMINO5MERCAPTO4H124TRIAZOLE

4461158

4AMINO3(PHENOXYMETHYL)1H124TRIAZOLE5THIONE

4AMINO5(PHENOXYMETHYL)124TRIAZOLE3THIOL

4AMINO5(PHENOXYMETHYL)4H124TRIAZOL3YLHYDROSULFIDE

4AMINO5(PHENOXYMETHYL)4H124TRIAZOLE3THIOL

4AMINO5PHENOXYMETHYL4H(124)TRIAZOLE3THIOL

4AZANYL3(PHENOXYMETHYL)1H124TRIAZOLE5THIONE

4TRIAZOLE3THIONE24DIHYDRO4AMINO5(PHENOXYMETHYL)3H2

C1=CC=C(C=C1)OCC2=NNC(=S)N2N

InChI=1SC9H10N4OSc10138(11129(13)15)6147421357h15H610H2(H1215)


BBL000476
Synonyms: 4-(propanoylamino)benzoicacid
Smiles: CCC(=O)Nc1ccc(cc1)C(=O)O

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CCC(=O)Nc1ccc(cc1)C(=O)O

PPROPIONAMIDOBENZOICACID

ZINC5428045

19313850

4(PROPANOYLAMINO)BENZOICACID

4(PROPIONYLAMINO)BENZOICACID

4PROPAMIDOBENZOICACID

4PROPANAMIDOBENZOICACID

4PROPIONAMIDOBENZOICACID

CCC(=O)NC1=CC=C(C=C1)C(=O)O

InChI=1SC10H11NO3c129(12)118537(468)10(13)14h36H2H21H3(H1112)(H1314)


BBL000477
Synonyms: 1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSCN1

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OC(=O)C1CSCN1

TETRAHYDROTHIAZOLE4CARBOXYLICACID

DLTHIAPROLINE

DLTHIAZOLIDINE4CARBOXYLICACID

DLTHIAZOLIDINECARBOXYLICACID

HEPALIDINE

HEPTALADINE

L()THIAZOLIDINE4CARBOXYLICACID

LTHIAZOLIDINE4CARBOXYLATE

LTHIAZOLIDINE4CARBOXYLICACID

LTHIOPROLINE

13THIAZOLIDIN3IUM4CARBOXYLATE

13THIAZOLIDINE4CARBOXYLICACID

THIAPROLINE

THIAZOLIDIN

THIAZOLIDIN4CARBOXYLICACID

THIAZOLIDINE4CARBOXYLICACID

THIAZOLIDINECARBOXYLICACID

THIAZOLIDINECARBOXYLICACID(VAN)

THIOBILINE

THIOPROLINE

TIAZOLIDIN

444279

4CARBOXYTHIAZOLIDINE

4THIAZOLIDINCARBOXYLICACID

4THIAZOLIDINECARBOXYLICACID

4THIAZOLIDINECARBOXYLICACID()

4THIAZOLIDINECARBOXYLICACIDL

ACIDEDLTHIAZOLIDINECARBOXYLIQUE4

ACIDEDLTHIAZOLIDINECARBOXYLIQUE4(FRENCH)

ACIDETHIAZOLIDINE4CARBOXYLIQUE

ACIDETHIAZOLIDINE4CARBOXYLIQUE(FRENCH)

C1C(NCS1)C(=O)O

InChI=1SC4H7NO2Sc64(7)318253h35H12H2(H67)


BBL000478
Synonyms: N-(2-hydrazinyl-2-oxoethyl)-3,4-dimethoxybenzamide(non-preferredname)
Smiles: NNC(=O)CNC(=O)c1ccc(c(c1)OC)OC

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NNC(=O)CNC(=O)c1ccc(c(c1)OC)OC

ZINC000000293865

ZINC00293865

ZINC293865

(34DIMETHOXYPHENYL)N(METHYL)CARBOXAMIDE

223675896

MFCD01131969

N(2HYDRAZINO2OXOETHYL)34DIMETHOXYBENZAMIDE

N(2HYDRAZINYL2OXOETHYL)34DIMETHOXYBENZAMIDE

N(2HYDRAZINYL2OXOETHYL)34DIMETHOXYBENZAMIDE(NONPREFERREDNAME)

N(34DIMETHOXYBENZOYL)GLYCINEHYDRAZIDE

NHYDRAZINOCARBONYLMETHYL34DIMETHOXYBENZAMIDE

COC1=C(C=C(C=C1)C(=O)NCC(=O)NN)OC

InChI=1SC11H15N3O4c1178437(59(8)182)11(16)13610(15)1412h35H612H212H3(H1316)(H1415)


BBL000479
Synonyms: N-(2-amino-4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(c(c1)N)NC(=O)C

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CCOc1ccc(c(c1)N)NC(=O)C

2AMINO4ETHOXYACETANILIDE

67169919

ACETAMIDEN(2AMINO4ETHOXYPHENYL)

MFCD00629011

N(2AMINO4ETHOXYPHENYL)ACETAMIDE

ZINC000000235544

ZINC00235544

ZINC235544

CCOC1=CC(=C(C=C1)NC(=O)C)N

InChI=1SC10H14N2O2c131484510(9(11)68)127(2)13h46H311H212H3(H1213)


BBL000480
Synonyms: 4-[(2-methylpropanoyl)amino]benzoicacid
Smiles: CC(C(=O)Nc1ccc(cc1)C(=O)O)C

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CC(C(=O)Nc1ccc(cc1)C(=O)O)C

ZINC3597303

28547071

4((2METHYLPROPANOYL)AMINO)BENZOICACID

4(2METHYLPROPANAMIDO)BENZOICACID

4(2METHYLPROPANOYLAMINO)BENZOICACID

4(ISOBUTYRYLAMINO)BENZOICACID

4ISOBUTYRAMIDOBENZOICACID

4ISOBUTYRYLAMINOBENZOICACID

BENZOICACID4((2METHYL1OXOPROPYL)AMINO)

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)O

InChI=1SC11H13NO3c17(2)10(13)129538(469)11(14)15h37H12H3(H1213)(H1415)


BBL000481
Synonyms: 1H-1,2,4-triazole-3-carboxamide
Smiles: NC(=O)c1n[nH]cn1

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NC(=O)c1n(nH)cn1

RIBAVIRINBASE

ZINC11612727

05083641

124TRIAZOLE3CARBOXAMIDE

1H(124)TRIAZOLE3CARBOXAMIDE

1H124TRIAZOLE3CARBOXAMIDE

1H124TRIAZOLE5CARBOXAMIDE

2H124TRIAZOLE3CARBOXAMIDE

3CARBAMOYL1H124TRIAZOLE


BBL000482
Synonyms: ethyl2-amino-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)scc1C

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CCOC(=O)c1c(N)scc1C

ETHYL2AMINO4METHYL3THIOPHENECARBOXYLATE

ETHYL2AMINO4METHYLTHIOPHENE3CARBOXYLATE

18614465

2AMINO3(ETHOXYCARBONYL)4METHYLTHIOPHENE

2AMINO4METHYL3ETHOXYCARBONYLTHIOPHENE

2AMINO4METHYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

3THIOPHENECARBOXYLICACID2AMINO4METHYLETHYLESTER

MFCD00051669

ZINC000000080323

ZINC00080323

ZINC80323

CCOC(=O)C1=C(SC=C1C)N

InChI=1SC8H11NO2Sc13118(10)65(2)4127(6)9h4H39H212H3


BBL000483
Synonyms: N-(phenylcarbonyl)-beta-alanine
Smiles: O=C(c1ccccc1)NCCC(=O)O

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O=C(c1ccccc1)NCCC(=O)O

ZINC000000012614

ZINC12614

MFCD00037293

N(PHENYLCARBONYL)BETAALANINE

NBENZOYLBETAALANINE

3(BENZOYLAMINO)PROPIONICACID

3(PHENYLCARBONYLAMINO)PROPANOICACID

3(PHENYLFORMAMIDO)PROPANOICACID

3440286

3BENZAMIDOPROPANOICACID

3BENZAMIDOPROPIONICACID

3BENZOYLAMINOPROPIONICACID

BENZOYLBALANINE

BENZOYLBETAALANINE

BENZOYLDLBETAALANINE

BETAALANINENBENZOYL

C1=CC=C(C=C1)C(=O)NCCC(=O)O

InChI=1SC10H11NO3c129(13)671110(14)8421358h15H67H2(H1114)(H1213)


BBL000484
Synonyms: 4-(4-methylphenyl)-4-oxobutanoicacid
Smiles: O=C(c1ccc(cc1)C)CCC(=O)O

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O=C(c1ccc(cc1)C)CCC(=O)O

ZINC000000098250

ZINC98250

MFCD00020541

3(4METHYLBENZOYL)PROPIONICACID

3(PTOLUOYL)PROPIONICACID

4(4METHYLPHENYL)4OXOBUTANOICACID

4(4METHYLPHENYL)4OXOBUTYRICACID

4619209

4OXO4(PTOLYL)BUTANOICACID

4OXO4PTOLYLBUTANOICACID

4OXO4PTOLYLBUTYRICACID

CC1=CC=C(C=C1)C(=O)CCC(=O)O

InChI=1SC11H12O3c18249(538)10(12)6711(13)14h25H67H21H3(H1314)


BBL000485
Synonyms: 1-phenyl-1H-tetrazole-5-thiol
Smiles: Sc1nnnn1c1ccccc1

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Sc1nnnn1c1ccccc1

ZINC17284974

1PH5SHTETRAZOL

1PHENYL1HTETRAZOL5THIOL

1PHENYL1HTETRAZOLE5(2H)THIONE

1PHENYL1HTETRAZOLE5THIOL

1PHENYL2HTETRAZOLE5THIONE

1PHENYL5MERCAPTO134TETRAZOLE

1PHENYL5MERCAPTO1HTETRAZOLE

1PHENYL5MERCAPTOTETRAZOL

1PHENYL5MERCAPTOTETRAZOLE

1PHENYL5TETRAZOLETHIONE

1PHENYL5THIO1HTETRAZOLE

1PHENYLTETRAZOLE5THIOL

1PHENYLTETRAZOLETHIOL

1PHENYLTETRAZOLINE5THIONE

2TETRAZOLINE5THIONE1PHENYL

5HTETRAZOLE5THIONE12DIHYDRO1PHENYL

5HTETRAZOLE5THIONE2DIHYDRO1PHENYL

5MERCAPTO1PHENYL1HTETRAZOLE

5MERCAPTO1PHENYLTETRAZOL

5MERCAPTO1PHENYLTETRAZOLE

5MERCAPTOLPHENYL1HTETRAZOLE

86931

1HTETRAZOL5YLTHIO1PHENYL

1HTETRAZOLE5THIOL1PHENYL

MERCAPTOPHENYLTETRAZOLE

PHENYLMERCAPTOTETRAZOLE

C1=CC=C(C=C1)N2C(=S)N=NN2

InChI=1SC7H6N4Sc127891011(7)6421356h15H(H81012)


BBL000486
Synonyms: 4-methyl-3-[(phenylcarbonyl)amino]benzoicacid
Smiles: O=C(c1ccccc1)Nc1cc(ccc1C)C(=O)O

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O=C(c1ccccc1)Nc1cc(ccc1C)C(=O)O

ZINC3213506

3(BENZOYLAMINO)4METHYLBENZOICACID

3BENZAMIDO4METHYLBENZOICACID

401828760

4METHYL3((PHENYLCARBONYL)AMINO)BENZOICACID

4METHYL3(PHENYLCARBONYLAMINO)BENZOICACID

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC=CC=C2

InChI=1SC15H13NO3c1107812(15(18)19)913(10)1614(17)115324611h29H1H3(H1617)(H1819)


BBL000487
Synonyms: [(2,4-dimethylphenyl)amino](oxo)aceticacid
Smiles: Cc1ccc(c(c1)C)NC(=O)C(=O)O

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Cc1ccc(c(c1)C)NC(=O)C(=O)O

856336395

((24DIMETHYLPHENYL)AMINO)(OXO)ACETICACID

((24DIMETHYLPHENYL)CARBAMOYL)FORMICACID

2((24DIMETHYLPHENYL)AMINO)2OXOACETICACID

MFCD09864512

ZINC000015416892

ZINC15416892

2(24dimethylanilino)2oxoaceticacid

CC1=CC(=C(C=C1)NC(=O)C(=O)O)C

InChI=1SC10H11NO3c16348(7(2)56)119(12)10(13)14h35H12H3(H1112)(H1314)


BBL000488
Synonyms: N-(3,4-dimethoxybenzyl)-3-methoxypropan-1-amine
Smiles: COCCCNCc1ccc(c(c1)OC)OC

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COCCCNCc1ccc(c(c1)OC)OC

919724439

METHOXYPROPYL)AMINE

MFCD08741863

N(34DIMETHOXYBENZYL)3METHOXYPROPAN1AMINE

ZINC000008728597

ZINC8728597

N((34dimethoxyphenyl)methyl)3methoxypropan1amine

COCCCNCC1=CC(=C(C=C1)OC)OC

InChI=1SC13H21NO3c1158471410115612(162)13(911)173h56914H47810H213H3


BBL000489
Synonyms: N-(2,6-dichlorophenyl)acetamide
Smiles: CC(=O)Nc1c(Cl)cccc1Cl

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CC(=O)Nc1c(Cl)cccc1Cl

N(26DICHLOROPHENYL)ACETAMIDE

NACETYL26DICHLOROANILINE

ZINC04016100

ZINC4016100

17700548

26DICHLOROACETANILIDE

ACETAMIDE6DICHLOROPHENYL)

ACETAMIDEN(26DICHLOROPHENYL)

ACETAMIDEN(26DICHLOROPHENYL)(9CI)

ACETANILIDE26DICHLORO

ACETANILIDE6DICHLORO

CC(=O)NC1=C(C=CC=C1Cl)Cl

InChI=1SC8H7Cl2NOc15(12)1186(9)3247(8)10h24H1H3(H1112)


BBL000490
Synonyms: (2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide
Smiles: NC(=S)N/N=C/c1ccc(o1)c1ccc(cc1)Cl

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NC(=S)NN=Cc1ccc(o1)c1ccc(cc1)Cl

ZINC000000372044

ZINC33309810

MFCD00695933

(2E)2((5(4CHLOROPHENYL)FURAN2YL)METHYLIDENE)HYDRAZINECARBOTHIOAMIDE

5(4CHLOROPHENYL)2FURALDEHYDETHIOSEMICARBAZONE

60698400

((E)(5(4chlorophenyl)furan2yl)methylideneamino)thiourea

C1=CC(=CC=C1C2=CC=C(O2)C=NNC(=S)N)Cl

InChI=1SC12H10ClN3OSc139318(249)116510(1711)7151612(14)18h17H(H3141618)b157+


BBL000491
Synonyms: methyl5-acetyl-2-amino-4-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(N)sc(c1C)C(=O)C

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COC(=O)c1c(N)sc(c1C)C(=O)C

4815310

5ACETYL2AMINO4METHYLTHIOPHENE3CARBOXYLICACIDMETHYLESTER

METHYL5ACETYL2AMINO4METHYL3THIOPHENECARBOXYLATE

METHYL5ACETYL2AMINO4METHYLTHIOPHENE3CARBOXYLATE

ZINC00570622

ZINC570622

CC1=C(SC(=C1C(=O)OC)N)C(=O)C

InChI=1SC9H11NO3Sc146(9(12)133)8(10)147(4)5(2)11h10H213H3


BBL000492
Synonyms: 2-(piperidin-1-yl)acetohydrazide
Smiles: NNC(=O)CN1CCCCC1

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NNC(=O)CN1CCCCC1

PIPERIDIN1YLACETICACIDHYDRAZIDE

ZINC15416198

1PIPERIDINEACETOHYDRAZIDE

2(1PIPERIDINYL)ACETOHYDRAZIDE

2(PIPERIDIN1YL)ACETOHYDRAZIDE

2PIPERIDIN1YLACETOHYDRAZIDE

2PIPERIDYLACETOHYDRAZIDE

C1CCN(CC1)CC(=O)NN

InChI=1SC7H15N3Oc897(11)6104213510h168H2(H911)


BBL000493
Synonyms: 2-(4-formylphenoxy)propanoicacid
Smiles: O=Cc1ccc(cc1)OC(C(=O)O)C

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O=Cc1ccc(cc1)OC(C(=O)O)C

PROPANOICACID2(4FORMYLPHENOXY)

ZINC000004045206

ZINC000004045207

2(4FORMYLPHENOXY)PROPANOICACID

2(4FORMYLPHENOXY)PROPIONICACID

51264789

MFCD03850823

CC(C(=O)O)OC1=CC=C(C=C1)C=O

InChI=1SC10H10O4c17(10(12)13)149428(611)359h27H1H3(H1213)


BBL000494
Synonyms: 2,5-dimethyl-1-phenyl-1H-pyrrole-3-carbaldehyde
Smiles: O=Cc1cc(n(c1C)c1ccccc1)C

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O=Cc1cc(n(c1C)c1ccccc1)C

PYRROLE3CARBOXALDEHYDE25DIMETHYL1PHENYL(8CI)

PYRROLE3CARBOXALDEHYDE5DIMETHYL1PHENYL

ZINC00040934

ZINC40934

1HPYRROLE3CARBOXALDEHYDE25DIMETHYL1PHENYL

1HPYRROLE3CARBOXALDEHYDE5DIMETHYL1PHENYL

1PHENYL25DIMETHYL1HPYRROLE3CARBALDEHYDE

25DIMETHYL1PHENYL1HPYRROLE3CARBALDEHYDE

25DIMETHYL1PHENYLPYRROLE3CARBALDEHYDE

25DIMETHYL1PHENYLPYRROLE3CARBOXALDEHYDE

83181

CC1=CC(=C(N1C2=CC=CC=C2)C)C=O

InChI=1SC13H13NOc110812(915)11(2)14(10)136435713h39H12H3


BBL000495
Synonyms: (2E)-3-(4-methoxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)c1ccc(cc1)C

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COc1ccc(cc1)C=CC(=O)c1ccc(cc1)C

ZINC05217248

ZINC5217248

(2E)3(4METHOXYPHENYL)1(4METHYLPHENYL)PROP2EN1ONE

(E)3(4METHOXYPHENYL)1(4METHYLPHENYL)PROP2EN1ONE

(E)3(4METHOXYPHENYL)1(PTOLYL)PROP2EN1ONE

(E)4METHOXY4METHYLCHALCONE

2PROPEN1ONE3(4METHOXYPHENYL)1(4METHYLPHENYL)(2E)

3(4METHOXYPHENYL)1(4METHYLPHENYL)2PROPEN1ONE

3(4METHOXYPHENYL)1(4METHYLPHENYL)PROP2EN1ONE

4METHOXY4METHYLCHALCONE

4METHYL4METHOXYCHALCONE

6552665

CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OC

InChI=1SC17H16O2c1133815(9413)17(18)1271451016(192)11614h312H12H3b127+


BBL000496
Synonyms: 4-[(4-methylpiperidin-1-yl)methyl]benzoicacid
Smiles: CC1CCN(CC1)Cc1ccc(cc1)C(=O)O

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CC1CCN(CC1)Cc1ccc(cc1)C(=O)O

4((4METHYL1PIPERIDINYL)METHYL)BENZOICACID

4((4METHYLPIPERIDIN1YL)METHYL)BENZOICACID

4((4METHYLPIPERIDYL)METHYL)BENZOICACID

926264553

ZINC09237175

ZINC9237175

4((4methylpiperidin1ium1yl)methyl)benzoate

CC1CC(NH+)(CC1)CC2=CC=C(C=C2)C(=O)(O)

InChI=1SC14H19NO2c1116815(9711)10122413(5312)14(16)17h2511H610H21H3(H1617)


BBL000497
Synonyms: 4-(3,4-dihydroquinolin-1(2H)-ylmethyl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)CN1CCCc2c1cccc2

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OC(=O)c1ccc(cc1)CN1CCCc2c1cccc2

ZINC11860434

4(34DIHYDROQUINOLIN1(2H)YLMETHYL)BENZOICACID

938355261

4(34dihydro2Hquinolin1ylmethyl)benzoicacid

C1CC2=CC=CC=C2N(C1)CC3=CC=C(C=C3)C(=O)O

InChI=1SC17H17NO2c1917(20)159713(81015)1218113514412616(14)18h124610H351112H2(H1920)


BBL000498
Synonyms: 4-{[(3-methoxypropyl)amino]methyl}-N,N-dimethylaniline
Smiles: COCCCNCc1ccc(cc1)N(C)C

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COCCCNCc1ccc(cc1)N(C)C

MFCD08741861

ZINC000008701739

ZINC8701739

4(((3METHOXYPROPYL)AMINO)METHYL)NNDIMETHYLANILINE

919724280

4((3methoxypropylamino)methyl)NNdimethylaniline

CN(C)C1=CC=C(C=C1)CNCCCOC

InChI=1SC13H22N2Oc115(2)137512(6813)11149410163h5814H4911H213H3


BBL000499
Synonyms: 3-[(phenylcarbonyl)amino]benzoicacid
Smiles: O=C(c1ccccc1)Nc1cccc(c1)C(=O)O

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O=C(c1ccccc1)Nc1cccc(c1)C(=O)O

ZINC98489

3((PHENYLCARBONYL)AMINO)BENZOICACID

3(BENZOYLAMINO)BENZOICACID

3(PHENYLCARBONYLAMINO)BENZOICACID

3BENZAMIDOBENZOICACID

3BENZOYLAMINOBENZOICACID

587542

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)O

InChI=1SC14H11NO3c1613(105213610)151284711(912)14(17)18h19H(H1516)(H1718)


BBL000500
Synonyms: 3-{[(4-chlorophenyl)carbonyl]amino}benzoicacid
Smiles: Clc1ccc(cc1)C(=O)Nc1cccc(c1)C(=O)O

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Clc1ccc(cc1)C(=O)Nc1cccc(c1)C(=O)O

MFCD00554076

ZINC000000286466

ZINC286466

3(((4CHLOROPHENYL)CARBONYL)AMINO)BENZOICACID

3((4CHLOROBENZOYL)AMINO)BENZOICACID

3(4CHLOROBENZAMIDO)BENZOICACID

413574795

BENZOICACID3(4CHLOROBENZOYLAMINO)

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI=1SC14H10ClNO3c1511649(5711)13(17)161231210(812)14(18)19h18H(H1617)(H1819)


BBL000501
Synonyms: 4-formyl-2-methoxyphenyl4-chlorobenzenesulfonate
Smiles: COc1cc(C=O)ccc1OS(=O)(=O)c1ccc(cc1)Cl

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COc1cc(C=O)ccc1OS(=O)(=O)c1ccc(cc1)Cl

ZINC02028642

ZINC2028642

(4FORMYL2METHOXYPHENYL)4CHLOROBENZENESULFONATE

432009499

4FORMYL2METHOXYPHENYL4CHLOROBENZENESULFONATE

COC1=C(C=CC(=C1)C=O)OS(=O)(=O)C2=CC=C(C=C2)Cl

InChI=1SC14H11ClO5Sc11914810(916)2713(14)2021(1718)125311(15)4612h29H1H3


BBL000502
Synonyms: 4-formylphenyl2-fluorobenzoate
Smiles: O=Cc1ccc(cc1)OC(=O)c1ccccc1F

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O=Cc1ccc(cc1)OC(=O)c1ccccc1F

ZINC00312722

ZINC312722

(4FORMYLPHENYL)2FLUOROBENZOATE

443676593

4FORMYLPHENYL2FLUOROBENZOATE

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=O)F

InChI=1SC14H9FO3c1513421312(13)14(17)18117510(916)6811h19H


BBL000503
Synonyms: [(4-methylbenzyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCc1ccc(cc1)C

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OC(=O)CSCc1ccc(cc1)C

ZINC000000266724

ZINC266724

MFCD02755455

((4METHYLBENZYL)SULFANYL)ACETICACID

((4METHYLBENZYL)THIO)ACETICACID

2(((4METHYLPHENYL)METHYL)SULFANYL)ACETICACID

2((4METHYLPHENYL)METHYLSULFANYL)ACETICACID

2((4METHYLPHENYL)METHYLTHIO)ACETICACID

58511209

ACETICACID2(((4METHYLPHENYL)METHYL)THIO)

CC1=CC=C(C=C1)CSCC(=O)O

InChI=1SC10H12O2Sc18249(538)613710(11)12h25H67H21H3(H1112)


BBL000504
Synonyms: 4-formyl-2-methoxyphenyl2-fluorobenzoate
Smiles: COc1cc(C=O)ccc1OC(=O)c1ccccc1F

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COc1cc(C=O)ccc1OC(=O)c1ccccc1F

ZINC00303376

ZINC303376

(4FORMYL2METHOXYPHENYL)2FLUOROBENZOATE

2FLUOROBENZOICACID4FORMYL2METHOXYPHENYLESTER

380193748

4FORMYL2METHOXYPHENYL2FLUOROBENZOATE

COC1=C(C=CC(=C1)C=O)OC(=O)C2=CC=CC=C2F

InChI=1SC15H11FO4c11914810(917)6713(14)2015(18)11423512(11)16h29H1H3


BBL000505
Synonyms: 4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)CN1CCc2c(C1)cccc2

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OC(=O)c1ccc(cc1)CN1CCc2c(C1)cccc2

YLMETHYL)BENZOICACID

ZINC00201330

ZINC201330

333357963

4((34DIHYDROISOQUINOLIN2(1H)YL)METHYL)BENZOICACID

4(34DIHYDRO1HISOQUINOLIN2YLMETHYL)BENZOICACID

4(34DIHYDRO2(1H)ISOQUINOLINYLMETHYL)BENZOICACID

4(34DIHYDROISOQUINOLIN2(1H)YLMETHYL)BENZOICACID


BBL000506
Synonyms: N-(2-methylphenyl)-N-(methylsulfonyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)C)c1ccccc1C

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OC(=O)CN(S(=O)(=O)C)c1ccccc1C

ZINC380160

N(2METHYLPHENYL)N(METHYLSULFONYL)GLYCINE

((2METHYLPHENYL)(METHYLSULFONYL)AMINO)ACETICACID

(METHANESULFONYLOTOLYLAMINO)ACETICACID

(N(2METHYLPHENYL)METHANESULFONAMIDO)ACETICACID

2((2METHYLPHENYL)(METHYLSULFONYL)AMINO)ACETICACID

2(2METHYLNMETHYLSULFONYLANILINO)ACETICACID

2(N(2METHYLPHENYL)METHANESULFONAMIDO)ACETIC

362695407

CC1=CC=CC=C1N(CC(=O)O)S(=O)(=O)C

InChI=1SC10H13NO4Sc1853469(8)11(710(12)13)16(214)15h36H7H212H3(H1213)


BBL000507
Synonyms: N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)C)c1ccc(c(c1)C)C

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OC(=O)CN(S(=O)(=O)C)c1ccc(c(c1)C)C

ZINC4673378

N(34DIMETHYLPHENYL)N(METHYLSULFONYL)GLYCINE

((34DIMETHYLPHENYL)METHANESULFONYLAMINO)ACETICACID

(N(34DIMETHYLPHENYL)METHANESULFONAMIDO)ACETICACID

2((34DIMETHYLPHENYL)(METHYLSULFONYL)AMINO)ACETICACID

2(34DIMETHYLNMETHYLSULFONYLANILINO)ACETICACID

2(N(34DIMETHYLPHENYL)METHANESULFONAMIDO)ACETICACID

425413521

CC1=C(C=C(C=C1)N(CC(=O)O)S(=O)(=O)C)C

InChI=1SC11H15NO4Sc184510(69(8)2)12(711(13)14)17(315)16h46H7H213H3(H1314)


BBL000508
Synonyms: [4-(dimethylamino)benzylidene]propanedinitrile
Smiles: CN(c1ccc(cc1)C=C(C#N)C#N)C

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CN(c1ccc(cc1)C=C(C#N)C#N)C

PNNDIMETHYLAMINOBENZALMALONONITRILE

PROPANEDINITRILE2((4(DIMETHYLAMINO)PHENYL)METHYLENE)

ZINC00173470

ZINC173470

((4(DIMETHYLAMINO)PHENYL)METHYLENE)METHANE11DICARBONITRILE

(4(DIMETHYLAMINO)BENZYLIDENE)MALONONITRILE

(4(DIMETHYLAMINO)BENZYLIDENE)PROPANEDINITRILE

(4DIMETHYLAMINOBENZYLIDEN)MALODINITRIL

(4DIMETHYLAMINOBENZYLIDENE)MALODINITRILE

2((4(DIMETHYLAMINO)PHENYL)METHYLENE)MALONONITRILE

2((4(DIMETHYLAMINO)PHENYL)METHYLIDENE)PROPANEDINITRILE

2((4DIMETHYLAMINOPHENYL)METHYLIDENE)PROPANEDINITRILE

2(4(DIMETHYLAMINO)BENZYLIDENE)MALONONITRILE

2(4DIMETHYLAMINOBENZYLIDENE)MALONITRILE((4(DIMETHYLAMINO)PHENYL)METHYLIDENE)PROPANEDINITRILE

2826280

4(NNDIMETHYLAMINO)BENZALMALONONITRILE

4DIMETHYLAMINOBENZYLIDENEMALONONITRILE

BENZENE1DIMETHYLAMINO4(22DICYANOETHENYL)

CN(C)C1=CC=C(C=C1)C=C(C#N)C#N

InChI=1SC12H11N3c115(2)125310(4612)711(813)914h37H12H3


BBL000509
Synonyms: oxo(piperidin-1-yl)aceticacid
Smiles: O=C(C(=O)O)N1CCCCC1

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O=C(C(=O)O)N1CCCCC1

OXO(1PIPERIDINYL)ACETICACID

OXO(PIPERIDIN1YL)ACETICACID

OXOPIPERIDIN1YLACETICACID

PIPERIDINOOXOACETICACID

ZINC4294472

2OXO2(PIPERIDIN1YL)ACETICACID

2OXO2PIPERIDIN1YLACETICACID

4706336

C1CCN(CC1)C(=O)C(=O)O

InChI=1SC7H11NO3c96(7(10)11)8421358h15H2(H1011)


BBL000510
Synonyms: [(3-chlorophenyl)amino](oxo)aceticacid
Smiles: Clc1cccc(c1)NC(=O)C(=O)O

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Clc1cccc(c1)NC(=O)C(=O)O

MFCD10018464

ZINC000015416963

ZINC15416963

((3CHLOROPHENYL)AMINO)(OXO)ACETICACID

((3CHLOROPHENYL)CARBAMOYL)FORMICACID

17709998

2((3CHLOROPHENYL)AMINO)2OXOACETICACID

2(3chloroanilino)2oxoaceticacid

C1=CC(=CC(=C1)Cl)NC(=O)C(=O)O

InChI=1SC8H6ClNO3c952136(45)107(11)8(12)13h14H(H1011)(H1213)


BBL000511
Synonyms: [(2-fluorophenyl)amino](oxo)aceticacid
Smiles: OC(=O)C(=O)Nc1ccccc1Cl

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OC(=O)C(=O)Nc1ccccc1Cl

ZINC19093125

77901509

((2CHLOROPHENYL)AMINO)(OXO)ACETICACID

((2CHLOROPHENYL)CARBAMOYL)FORMICACID

2((2CHLOROPHENYL)AMINO)2OXOACETICACID

2(2chloroanilino)2oxoaceticacid

C1=CC=C(C(=C1)NC(=O)C(=O)O)Cl

InChI=1SC8H6ClNO3c9531246(5)107(11)8(12)13h14H(H1011)(H1213)


BBL000512
Synonyms: 2-(benzylsulfanyl)propanoicacid
Smiles: CC(C(=O)O)SCc1ccccc1

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CC(C(=O)O)SCc1ccccc1

2(BENZYLSULFANYL)PROPANOICACID

2(BENZYLTHIO)PROPANOICACID

2899641

2BENZYLSULFANYLPROPANOICACID

MFCD00052369

PROPANOICACID2((PHENYLMETHYL)THIO)

ZINC000000136475

ZINC000000136477

CC(C(=O)O)SCC1=CC=CC=C1

InChI=1SC10H12O2Sc18(10(11)12)1379532469h268H7H21H3(H1112)


BBL000513
Synonyms: [(2-methylbenzyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCc1ccccc1C

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OC(=O)CSCc1ccccc1C

ZINC000000567353

ZINC567353

MFCD03547593

((2METHYLBENZYL)SULFANYL)ACETICACID

((2METHYLBENZYL)THIO)ACETICACID

18926493

2(((2METHYLPHENYL)METHYL)SULFANYL)ACETICACID

2((2METHYLBENZYL)THIO)ACETICACID

2((2METHYLPHENYL)METHYLSULFANYL)ACETICACID

2((2METHYLPHENYL)METHYLTHIO)ACETICACID

CC1=CC=CC=C1CSCC(=O)O

InChI=1SC10H12O2Sc1842359(8)613710(11)12h25H67H21H3(H1112)


BBL000514
Synonyms: [(3,5-dimethylphenyl)amino](oxo)aceticacid
Smiles: O=C(C(=O)O)Nc1cc(C)cc(c1)C

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O=C(C(=O)O)Nc1cc(C)cc(c1)C

ZINC19093312

((35DIMETHYLPHENYL)AMINO)(OXO)ACETICACID

((35DIMETHYLPHENYL)CARBAMOYL)FORMICACID

1018295152

2((35DIMETHYLPHENYL)AMINO)2OXOACETICACID

2(35dimethylanilino)2oxoaceticacid

CC1=CC(=CC(=C1)NC(=O)C(=O)O)C

InChI=1SC10H11NO3c1637(2)58(46)119(12)10(13)14h35H12H3(H1112)(H1314)


BBL000515
Synonyms: azepan-1-yl(oxo)aceticacid
Smiles: O=C(C(=O)O)N1CCCCCC1

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O=C(C(=O)O)N1CCCCCC1

ZINC4312751

1AZEPANYL(OXO)ACETICACID

1HAZEPINE1ACETICACIDHEXAHYDROAOXO

2(AZEPAN1YL)2OXOACETICACID

886505595

AZEPAN1YL(OXO)ACETICACID

AZEPAN1YLOXOACETICACID

C1CCCN(CC1)C(=O)C(=O)O

InChI=1SC8H13NO3c107(8(11)12)95312469h16H2(H1112)


BBL000516
Synonyms: oxo(propan-2-ylamino)aceticacid
Smiles: CC(NC(=O)C(=O)O)C

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CC(NC(=O)C(=O)O)C

(ISOPROPYLAMINO)(OXO)ACETICACID

(ISOPROPYLCARBAMOYL)FORMICACID

2(ISOPROPYLAMINO)2OXOACETICACID

29262575

2OXO2(PROPAN2YLAMINO)ACETICACID

ACETICACID2((1METHYLETHYL)AMINO)2OXO

MFCD06740186

NISOPROPYLOXALAMICACID

NISOPROPYLOXAMICACID

NISOPROPYLOXAMIDICACID

OXO(PROPAN2YLAMINO)ACETICACID

ZINC000004312755

ZINC4312755

CC(C)NC(=O)C(=O)O

InChI=1SC5H9NO3c13(2)64(7)5(8)9h3H12H3(H67)(H89)


BBL000517
Synonyms: [(2,5-dimethylphenyl)amino](oxo)aceticacid
Smiles: Cc1ccc(cc1NC(=O)C(=O)O)C

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Cc1ccc(cc1NC(=O)C(=O)O)C

959240416

((25DIMETHYLPHENYL)AMINO)(OXO)ACETICACID

((25DIMETHYLPHENYL)CARBAMOYL)FORMICACID

2((25DIMETHYLPHENYL)AMINO)2OXOACETICACID

ZINC19092208

2(25dimethylanilino)2oxoaceticacid

CC1=CC(=C(C=C1)C)NC(=O)C(=O)O

InChI=1SC10H11NO3c16347(2)8(56)119(12)10(13)14h35H12H3(H1112)(H1314)


BBL000518
Synonyms: (butan-2-ylamino)(oxo)aceticacid
Smiles: CC(NC(=O)C(=O)O)CC

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CC(NC(=O)C(=O)O)CC

2(SECBUTYLAMINO)2OXOACETICACID

80638535

((SECBUTYL)CARBAMOYL)FORMICACID

(BUTAN2YLAMINO)(OXO)ACETICACID

(SECBUTYLAMINO)(OXO)ACETICACID

MFCD09971254

OXAMICACIDESTER31

ZINC000019092237

ZINC000019092241

2(butan2ylamino)2oxoaceticacid

CCC(C)NC(=O)C(=O)O

InChI=1SC6H11NO3c134(2)75(8)6(9)10h4H3H212H3(H78)(H910)


BBL000519
Synonyms: [(4-fluorophenyl)amino](oxo)aceticacid
Smiles: O=C(C(=O)O)Nc1ccc(cc1)F

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O=C(C(=O)O)Nc1ccc(cc1)F

ZINC000019092131

ZINC19092131

MFCD09864524

((4FLUOROPHENYL)AMINO)(OXO)ACETICACID

((4FLUOROPHENYL)CARBAMOYL)FORMICACID

2((4FLUOROPHENYL)AMINO)2OXOACETICACID

69066439

ACETICACID2((4FLUOROPHENYL)AMINO)2OXO

2(4fluoroanilino)2oxoaceticacid

C1=CC(=CC=C1NC(=O)C(=O)O)F

InChI=1SC8H6FNO3c95136(425)107(11)8(12)13h14H(H1011)(H1213)


BBL000520
Synonyms: (cyclopentylamino)(oxo)aceticacid
Smiles: O=C(C(=O)O)NC1CCCC1

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O=C(C(=O)O)NC1CCCC1

ZINC19092854

(CYCLOPENTYLAMINO)(OXO)ACETICACID

(CYCLOPENTYLCARBAMOYL)FORMICACID

183235805

2(CYCLOPENTYLAMINO)2OXOACETICACID

C1CCC(C1)NC(=O)C(=O)O

InChI=1SC7H11NO3c96(7(10)11)8531245h5H14H2(H89)(H1011)


BBL000521
Synonyms: [(2-chlorophenyl)amino](oxo)aceticacid
Smiles: OC(=O)C(=O)Nc1ccccc1F

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OC(=O)C(=O)Nc1ccccc1F

ZINC19092067

((2FLUOROPHENYL)AMINO)(OXO)ACETICACID

((2FLUOROPHENYL)CARBAMOYL)FORMICACID

2((2FLUOROPHENYL)AMINO)2OXOACETICACID

84944150

ACETICACID2((2FLUOROPHENYL)AMINO)2OXO

2(2fluoroanilino)2oxoaceticacid

C1=CC=C(C(=C1)NC(=O)C(=O)O)F

InChI=1SC8H6FNO3c9531246(5)107(11)8(12)13h14H(H1011)(H1213)


BBL000522
Synonyms: 5,6-dimethyl-3-phenyl-2-(prop-2-en-1-ylsulfanyl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCSc1nc2sc(c(c2c(=O)n1c1ccccc1)C)C

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C=CCSc1nc2sc(c(c2c(=O)n1c1ccccc1)C)C

123971799

56DIMETHYL3PHENYL2(PROP2EN1YLSULFANYL)THIENO(23D)PYRIMIDIN4(3H)ONE

56DIMETHYL3PHENYL2PROP2ENYLSULFANYLTHIENO(23D)PYRIMIDIN4ONE

56DIMETHYL3PHENYL2PROP2ENYLTHIO3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE

MFCD01793552

ZINC000002465731

ZINC02465731

ZINC2465731

CC1=C(SC2=C1C(=O)N(C(=N2)SCC=C)C3=CC=CC=C3)C

InChI=1SC17H16N2OS2c14102117181514(11(2)12(3)2215)16(20)19(17)138657913h49H110H223H3


BBL000523
Synonyms: 2-amino-1H-isoindole-1,3(2H)-dione
Smiles: NN1C(=O)c2c(C1=O)cccc2

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NN1C(=O)c2c(C1=O)cccc2

NNPHTHALOYLHYDRAZINE

NNPHTHALOYLHYDRAZINEUNSYM

PHTHALHYDRAZIDE(VAN)

PHTHALICACIDCYCLICHYDRAZIDE

PHTHALICACIDCYCLICHYDRAZIDE(VAN)

CYCLOPHTHALYLHYDRAZIDE

HYDRAZINE1(12PHENYLENEDICARBONYL)

HYDRAZINE11(12PHENYLENEDICARBONYL)

HYDRAZINE11PHTHALOYL

HYDRAZINE1PHTHALOYL

NAMINOPHTHALAMIDE

NAMINOPHTHALIMIDE

11PHTHALOYLHYDRAZINE

1875485

PHTHALIMIDENAMINO

PHTHALIMIDENAMINO(8CI)

PHTHALOCYCLOHYDRAZIDE(VAN)

ZINC00157180

ZINC157180

1HISOINDOLE12AMINO

1HISOINDOLE13(2H)DIONE2AMINO

1HISOINDOLE13(2H)DIONE2AMINO(9CI)

2AMINO1HISOINDOLE13(2H)DIONE

2AMINO23DIHYDRO1HISOINDOLE13DIONE

2AMINOBENZO(C)AZOLIDINE13DIONE

2AMINOISOINDOLE13DIONE

2AMINOISOINDOLINE13DIONE

C1=CC=C2C(=C1)C(=O)N(C2=O)N

InChI=1SC8H6N2O2c9107(11)531246(5)8(10)12h14H9H2


BBL000524
Synonyms: 4-phenyl-1,3-thiazole-2-thiol
Smiles: Sc1scc(n1)c1ccccc1

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Sc1scc(n1)c1ccccc1

ZINC000001596410

ZINC1596410

MFCD00014508

2(3H)THIAZOLETHIONE4PHENYL

2(3H)THIAZOLETHIONE4PHENYL4PHENYL2(3H)THIAZOLETHION4PHENYL2MERCAPTOTHIAZOLE4PHENYL2THIAZOLETHIO

2103880

2MERCAPTO4PHENYLTHIAZOLE

2THIAZOLETHIOL4PHENYL

4PHENYL13THIAZOLE2THIOL

4PHENYL23DIHYDRO13THIAZOLE2THIONE

4PHENYL2MERCAPTOTHIAZOLE

4PHENYL2THIAZOLETHIOL

4PHENYL3H13THIAZOLE2THIONE

4PHENYL3HTHIAZOLE2THIONE

4PHENYLTHIAZOLE2(3H)THIONE

4PHENYLTHIAZOLE2THIOL

4THIAZOLINE2THIONE4PHENYL

C1=CC=C(C=C1)C2=CSC(=S)N2

InChI=1SC9H7NS2c119108(6129)7421357h16H(H1011)


BBL000525
Synonyms: 1-(chloromethyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Smiles: ClC[Si]12OCCN(CCO1)CCO2

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ClC(Si)12OCCN(CCO1)CCO2

CMSILATRANE

MFCD00053377

ZINC000169746475

ZINC169746475

CHLOROMETHYLSILATRANE

1(CHLOROMETHYL)289TRIOXA5AZA1SILABICYCLO(333)UNDECANE

1(CHLOROMETHYL)SILATRANE

1CHLOROMETHYL289TRIOXA5AZA1SILABICYCLO(333)UNDECANE

1CHLOROMETHYLSILATRANE

289TRIOXA5AZA1SILABICYCLO(333)UNDECANE1(CHLOROMETHYL)

42003394

5(chloromethyl)4611trioxa1aza5silabicyclo(333)undecane

C1CO(Si)2(OCCN1CCO2)CCl

InChI=1SC7H14ClNO3Sic871310419(251113)361213h17H2


BBL000526
Synonyms: 5,5'-carbonylbis(2-benzofuran-1,3-dione)
Smiles: O=C(c1ccc2c(c1)C(=O)OC2=O)c1ccc2c(c1)C(=O)OC2=O

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O=C(c1ccc2c(c1)C(=O)OC2=O)c1ccc2c(c1)C(=O)OC2=O

MFCD00005923

13ISOBENZOFURANDIONE55CARBONYLBIS

155CARBONYLBIS

PHTHALICANHYDRIDE44CARBONYLDI

PHTHALICANHYDRIDE44CARBONYLDI(8CI)

PHTHALICANHYDRIDE4CARBONYLDI

ZINC000095738316

ZINC95738316

2421285

344BENZOPHENONETETRACARBOXYLICACIDDIANHYDRIDE

344BENZOPHENONETETRACARBOXYLICDIANHYDRIDE

344TETRACARBOXYBENZOPHENONEDIANHYDRIDE

44CARBONYLBIS(PHTHALICANHYDRIDE)

44CARBONYLDIPHTHALICANHYDRIDE

44DIPHTHALICANHYDRIDEKETONE

5((13BIS(OXIDANYLIDENE)2BENZOFURAN5YL)CARBONYL)2BENZOFURAN13DIONE

5((13DIOXO5ISOBENZOFURANYL)OXOMETHYL)ISOBENZOFURAN13DIONE

5((13DIOXOISOBENZOFURAN5YL)CARBONYL)ISOBENZOFURAN13DIONE

5(13DIOXO13DIHYDRO2BENZOFURAN5CARBONYL)13DIHYDRO2BENZOFURAN13DIONE

5(13DIOXO2BENZOFURAN5CARBONYL)2BENZOFURAN13DIONE

5(13DIOXOISOBENZOFURAN5CARBONYL)ISOBENZOFURAN13DIONE

55CARBONYLBIS(2BENZOFURAN13DIONE)

55CARBONYLBIS(ISOBENZOFURAN13DIONE)

BENZOPHENONETETRACARBOXYLICACIDANHYDRIDE

BENZOPHENONETETRACARBOXYLICACIDDIANHYDRIDE

BENZOPHENONETETRACARBOXYLICANHYDRIDE

BENZOPHENONETETRACARBOXYLICDIANHYDRIDE

C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O

InChI=1SC17H6O7c1813(713911(57)16(21)2314(9)19)8241012(68)17(22)2415(10)20h16H


BBL000527
Synonyms: 4,5,6,7-tetrachloro-2-benzofuran-1,3-dione
Smiles: O=C1OC(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl

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O=C1OC(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl

4567tetrachloro2benzofuran13dione

117088

13ISOBENZOFURANDIONETETRACHLORO

ETRACHLOROPHTHALICACIDANHYDRIDE

MFCD00005920

PHTHALICANHYDRIDETETRACHLORO

TETRACHLORO13DIHYDRO2BENZOFURAN13DIONE

TETRACHLOROPHTHALICACIDANHYDRIDE

TETRACHLOROPHTHALICANHYDRIDE

TETRATHAL

ZINC000008585889

ZINC8585889

C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O

InChI=1SC8Cl4O3c9312(8(14)157(1)13)4(10)6(12)5(3)11


BBL000528
Synonyms: 2,3-dihydroxybenzaldehyde
Smiles: O=Cc1cccc(c1O)O

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O=Cc1cccc(c1O)O

OPYROCATECHUALDEHYDE

ZINC000000332561

ZINC00332561

ZINC332561

MFCD00003324

23DIHYDROXYBENZALDEHYDE

23DIHYDROXYBENZALDEHYDE98

23DIHYDROXYBENZALDEHYDE99

24677789

3FORMYL12BENZENEDIOL

56DIHYDROXYBENZALDEHYDE

BENZALDEHYDE23DIHYDROXY

C1=CC(=C(C(=C1)O)O)C=O

InChI=1SC7H6O3c8452136(9)7(5)10h14910H


BBL000529
Synonyms: 3-[(pyrrolidin-1-ylcarbonothioyl)sulfanyl]propanoicacid
Smiles: S=C(N1CCCC1)SCCC(=O)O

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S=C(N1CCCC1)SCCC(=O)O

ZINC187671

3((PYRROLIDIN1YLCARBONOTHIOYL)SULFANYL)PROPANOICACID

3(PYRROLIDINE1CARBOTHIOYLSULFANYL)PROPANOICACID

3(PYRROLIDINE1CARBOTHIOYLSULFANYL)PROPIONICACID

3(PYRROLIDINYLTHIOXOMETHYLTHIO)PROPANOICACID

81994776

C1CCN(C1)C(=S)SCCC(=O)O

InChI=1SC8H13NO2S2c107(11)36138(12)941259h16H2(H1011)


BBL000530
Synonyms: N-(methylsulfonyl)-N-(2-phenylethyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)C)CCc1ccccc1

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OC(=O)CN(S(=O)(=O)C)CCc1ccccc1

ZINC619800

N(METHYLSULFONYL)N(2PHENYLETHYL)GLYCINE

(METHANESULFONYLPHENETHYLAMINO)ACETICACID

(N(2PHENYLETHYL)METHANESULFONAMIDO)ACETICACID

2((METHYLSULFONYL)(2PHENYLETHYL)AMINO)ACETICACID

2(METHYLSULFONYL(PHENETHYL)AMINO)ACETICACID

2(NPHENETHYLMETHYLSULFONAMIDO)ACETICACID

35839522

2(methylsulfonyl(2phenylethyl)amino)aceticacid

CS(=O)(=O)N(CCC1=CC=CC=C1)CC(=O)O

InChI=1SC11H15NO4Sc117(1516)12(911(13)14)87105324610h26H79H21H3(H1314)


BBL000531
Synonyms: 7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)cc2C

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Oc1ccc2c(c1)oc(=O)cc2C

RESOCYANINE

UMBELLIFERONE4METHYL

ZINC000000058121

ZINC00058121

ZINC58121

2H1BENZOPYREN2ONE7HYDROXY4METHYL

2HYDROXY4METHYL7H1BENZOPYRAN7ONE

4METHYL7HYDROXYCOUMARIN

4METHYL7OXIDANYLCHROMEN2ONE

4METHYLUMBELLIFERON

4METHYLUMBELLIFERONE

4METHYLUMBELLIFERONE(4MU)

4METHYLUMBELLIFERONE4MU

4METHYLUMBELLIFERONESUPPLIEDBYSELLECKCHEMICALS

7H1BENZOPYRAN7ONE2HYDROXY4METHYL

7HYDROXY4METHYL1BENZOPYRAN2ONE

7HYDROXY4METHYL2H1BENZOPYRAN2ONE

7HYDROXY4METHYL2H2CHROMENONE

7HYDROXY4METHYL2HCHROMEN2ONE

7HYDROXY4METHYL2OXO2H1BENZOPYRAN

7HYDROXY4METHYL2OXO2HCHROMENE

7HYDROXY4METHYL2OXO3CHROMENE

7HYDROXY4METHYLCHROMEN2ONE

7HYDROXY4METHYLCOUMARIN

7HYDROXY4METHYLCOUMARINE

90335

BETAMETHYLUMBELLIFERONE

2H1BENZOPYRAN2ONE7HYDROXY4METHYL

2H1BENZOPYRAN7HYDROXY4METHYL2OXO

CHOLESTIL

COUMARIN4

COUMARIN7HYDROXY4METHYL

COUMARINDERIVATIVE3B

HYMECHROME

HYMECROMONE

HYMECROMONE(7HYDROXY4METHYLCOUMARIN)

HYMECROMONE(JP16USANINN)

HYMECROMONE(USANINNBANJAN)

HYMECROMONE(USANINNJAN)

IMECROMONE

IMECROMONE(DCIT)

METHYLUMBELLIFERONEBETA

MFCD00006866

CC1=CC(=O)OC2=C1C=CC(=C2)O

InChI=1SC10H8O3c16410(12)13957(11)238(6)9h2511H1H3


BBL000532
Synonyms: [4-(acetylamino)phenoxy]aceticacid
Smiles: OC(=O)COc1ccc(cc1)NC(=O)C

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OC(=O)COc1ccc(cc1)NC(=O)C

ZINC93096

(4(ACETYLAMINO)PHENOXY)ACETICACID

(4ACETAMIDOPHENOXY)ACETICACID

(4ACETYLAMINOPHENOXY)ACETICACID

2(4(ACETYLAMINO)PHENOXY)ACETICACID

2(4ACETAMIDOPHENOXY)ACETICACID

2(PACETAMIDOPHENOXY)ACETICACID

39149138

4ACETAMIDOPHENOXYACETICACID

4ACETAMINOPHENOXYACETICACID

ACETAMIDOPHENOXYACETICACID

ACETICACID(4(ACETYLAMINO)PHENOXY)

ACETICACID(PACETAMIDOPHENOXY)

ACETICACID2(4(ACETYLAMINO)PHENOXY)

CC(=O)NC1=CC=C(C=C1)OCC(=O)O

InChI=1SC10H11NO4c17(12)118249(538)15610(13)14h25H6H21H3(H1112)(H1314)


BBL000533
Synonyms: 5-bromo-1H-benzotriazole
Smiles: Brc1ccc2c(c1)nn[nH]2

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Brc1ccc2c(c1)nn(nH)2

ZINC19859472

1H123BENZOTRIAZOLE5BROMO

1HBENZOTRIAZOLE6BROMO

32046621

5BROMO1H123BENZOTRIAZOLE

5BROMO1HBENZO(D)(123)TRIAZOLE

5BROMO1HBENZO(D)123TRIAZOLE

5BROMO1HBENZOTRIAZOLE

5BROMO2H123BENZOTRIAZOLE

5BROMO2HBENZOTRIAZOLE

5BROMOBENZOTRIAZOLE

6BROMO1H123BENZOTRIAZOLE

6BROMO1HBENZO(D)(123)TRIAZOLE

6BROMO1HBENZOTRIAZOLE

6BROMOBENZOTRIAZOLE

C1=CC2=NNN=C2C=C1Br

InChI=1SC6H4BrN3c741256(34)91085h13H(H8910)


BBL000534
Synonyms: 2'-formylbiphenyl-2-carboxylicacid
Smiles: O=Cc1ccccc1c1ccccc1C(=O)O

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O=Cc1ccccc1c1ccccc1C(=O)O

ZINC000002525617

ZINC2525617

MFCD04039066

(11BIPHENYL)2CARBOXYLICACID2FORMYL

2(2FORMYLPHENYL)BENZOICACID

2(2METHANOYLPHENYL)BENZOICACID

2FORMYL(11BIPHENYL)2CARBOXYLICACID

2FORMYLBIPHENYL2CARBOXYLICACID

6720269

C1=CC=C(C(=C1)C=O)C2=CC=CC=C2C(=O)O

InChI=1SC14H10O3c15910512611(10)12734813(12)14(16)17h19H(H1617)


BBL000535
Synonyms: 3-(furan-2-yl)benzaldehyde
Smiles: O=Cc1cccc(c1)c1ccco1

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O=Cc1cccc(c1)c1ccco1

ZINC02522290

ZINC2522290

KETONE3FURYLPHENYL

METHANONE3FURANYLPHENYL

METHANONE3FURFANYLPHENYL

METHANONE3FURFANYLPHENYL(9CI)

2(3FORMYLPHENYL)FURAN

3(2FURANYL)BENZAIDEHYDE

3(2FURANYL)BENZALDEHYDE

3(2FURYL)BENZALDEHYDE

3(FUR2YL)BENZALDEHYDE

3(FURAN2YL)BENZALDEHYDE

3FURAN2YLBENZALDEHYDE

3FURANYLPHENYLMETHANONE

3FURFANYLPHENYLMETHANONE

3FURYLPHENYLKETONE

85553522

BENZALDEHYDE3(2FURANYL)

C1=CC(=CC(=C1)C=O)C2=CC=CO2

InChI=1SC11H8O2c128931410(79)115261311h18H


BBL000536
Synonyms: N-(2-phenylethyl)acetamide
Smiles: CC(=O)NCCc1ccccc1

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CC(=O)NCCc1ccccc1

(2PHENETHYL)ACETAMIDE

877952

ACETAMIDEN(2PHENYLETHYL)

ACETAMIDENPHENETHYL

ACETAMIDENPHENETHYL(6CI7CI8CI)

ACETYLPHENETHYLAMINE

N(2PHENETHYL)ACETAMIDE

N(2PHENYLETHYL)ACETAMIDE

N(PHENETHYL)ACETAMIDE

NACETYL(2PHENYL)ETHYLAMINE

NACETYL2PHENYLETHYLAMINE

NACETYLPHENETHYLAMINE

NBETAPHENYLETHYLACETAMIDE

NPHENETHYLACETAMIDE

ZINC00163574

ZINC163574

CC(=O)NCCC1=CC=CC=C1

InChI=1SC10H13NOc19(12)1187105324610h26H78H21H3(H1112)


BBL000537
Synonyms: N-(4-methyl-2-nitrophenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1[N+](=O)[O-])C

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CC(=O)Nc1ccc(cc1(N+)(=O)(O))C

MFCD00024538

N(4METHYL2NITROPHENYL)ACETAMIDE

N1(4METHYL2NITROPHENYL)ACETAMIDE

PACETOTOLUIDIDE2NITRO

ZINC000004014521

ZINC04014521

ZINC4014521

2NITRO4METHYLACETANILIDE

2NITROACETOPTOLUIDIDE

2NITROPACETOTOLUIDIDE

4(NACETYL)AMINO3NITROTOLUENE

4ACETYLAMINO3NITROTOLUENE

4METHYL2NITROACETANILIDE

4METHYL2NITRONACETYLBENZENEAMINE

612453

ACETAMIDEN(4METHYL2NITROPHENYL)

CARBAMICACID(4METHYL2NITROPHENYL)METHYLESTER(9CI)

CC1=CC(=C(C=C1)NC(=O)C)(N+)(=O)(O)

InChI=1SC9H10N2O3c16348(107(2)12)9(56)11(13)14h35H12H3(H1012)


BBL000538
Synonyms: 4-nitrobiphenyl
Smiles: [O-][N+](=O)c1ccc(cc1)c1ccccc1

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(O)(N+)(=O)c1ccc(cc1)c1ccccc1

11BIPHENYL4NITRO

1NITRO4PHENYLBENZENE

4NITRO11BIPHENYL

4NITROBIPHENYL

4NITRODIPHENYL

4NITROLBIPHENYL

4PHENYLNITROBENZENE

92933

BIPHENYL4NITRO

MFCD00007342

NITRO11BIPHENYL

PNITROBIPHENYL

PNITRODIPHENYL

PPHENYLNITROBENZENE

ZINC000001591846

ZINC01591846

ZINC1591846

C1=CC=C(C=C1)C2=CC=C(C=C2)(N+)(=O)(O)

InChI=1SC12H9NO2c1413(15)128611(7912)104213510h19H


BBL000539
Synonyms: (4Z)-4-(phenylimino)pentan-2-one
Smiles: C/C(=N/c1ccccc1)/CC(=O)C

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CC(=Nc1ccccc1)CC(=O)C

(4Z)4(phenylimino)pentan2one

880126


BBL000540
Synonyms: 4-amino-N-(2-hydroxyethyl)-N-methylbenzenesulfonamide
Smiles: OCCN(S(=O)(=O)c1ccc(cc1)N)C

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OCCN(S(=O)(=O)c1ccc(cc1)N)C

S(4AMINOPHENYL)2HYDROXYNMETHYLETHANESULFONAMIDO

ZINC00211528

ZINC211528

4AMINON(2HYDROXYETHYL)NMETHYLBENZENESULFONAMIDE

CN(CCO)S(=O)(=O)C1=CC=C(C=C1)N

InChI=1SC9H14N2O3Sc111(6712)15(1314)9428(10)359h2512H6710H21H3


BBL000541
Synonyms: 3-(5-methylfuran-2-yl)benzaldehyde
Smiles: O=Cc1cccc(c1)c1ccc(o1)C

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O=Cc1cccc(c1)c1ccc(o1)C

ZINC000002505855

ZINC02505855

ZINC2505855

3(5METHYL2FURYL)BENZALDEHYDE

3(5METHYLFURAN2YL)BENZALDEHYDE

400745031

MFCD03030047

CC1=CC=C(O1)C2=CC(=CC=C2)C=O

InChI=1SC12H10O2c195612(149)1142310(711)813h28H1H3


BBL000542
Synonyms: N-[(E)-1H-indol-3-ylmethylidene]-4H-1,2,4-triazol-4-amine
Smiles: c1ccc2c(c1)c(c[nH]2)/C=N/n1cnnc1

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c1ccc2c(c1)c(c(nH)2)C=Nn1cnnc1

N((E)1Hindol3ylmethylidene)4H124triazol4amine

35554746


BBL000543
Synonyms: 2'-aminobiphenyl-4-carboxylicacid
Smiles: Nc1ccccc1c1ccc(cc1)C(=O)O

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Nc1ccccc1c1ccc(cc1)C(=O)O

P(2AMINOPHENYL)BENZOICACID

ZINC000002522308

ZINC2522308

MFCD03990479

2AMINO(11BIPHENYL)4CARBOXYLICACID

2AMINO11BIPHENYL4CARBOXYLICACID

2AMINO4BIPHENYLCARBOXYLICACID

2AMINOBIPHENYL4CARBOXYLICACID

4(2AMINOPHENYL)BENZOICACID

5730778

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)O)N

InChI=1SC13H11NO2c1412421311(12)95710(869)13(15)16h18H14H2(H1516)


BBL000544
Synonyms: 4-amino-5-(3-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1cccc(c1)c1nnc(n1N)S

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Clc1cccc(c1)c1nnc(n1N)S

ZINC3886910

117320668

3H124TRIAZOLE3THIONE4AMINO5(3CHLOROPHENYL)24DIHYDRO

4AMINO3(3CHLOROPHENYL)1H124TRIAZOLE5THIONE

4AMINO5(3CHLOROPHENYL)124TRIAZOLE3THIOL

4AMINO5(3CHLOROPHENYL)2H124TRIAZOLE3THIONE

4AMINO5(3CHLOROPHENYL)4H(124)TRIAZOLE3THIOL

4AMINO5(3CHLOROPHENYL)4H124TRIAZOLE3THIOL

C1=CC(=CC(=C1)Cl)C2=NNC(=S)N2N

InChI=1SC8H7ClN4Sc963125(46)711128(14)13(7)10h14H10H2(H1214)


BBL000545
Synonyms: N-[(benzyloxy)carbonyl]glycylglycine
Smiles: O=C(OCc1ccccc1)NCC(=O)NCC(=O)O

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O=C(OCc1ccccc1)NCC(=O)NCC(=O)O

(((((BENZYLOXY)CARBONYL)AMINO)ACETYL)AMINO)ACETICACID

(2(((BENZYLOXY)CARBONYL)AMINO)ACETAMIDO)ACETICACID

ZINC1655961

(2BENZYLOXYCARBONYLAMINOACETYLAMINO)ACETICACID

(CARBOBENZOXY)GLYCYLGLYCINE

(NCBZGLYCYL)GLYCINE

2((2(BENZYLOXYCARBONYLAMINO)ACETYL)AMINO)ACETICACID

2((2(PHENYLMETHOXYCARBONYLAMINO)ACETYL)AMINO)ACETICACID

2((2PHENYLMETHOXYCARBONYLAMINOACETYL)AMINO)ACETICACID

2(2(((BENZYLOXY)CARBONYL)AMINO)ACETAMIDO)ACETICACID

2(2((PHENYLMETHOXY)CARBONYLAMINO)ACETYLAMINO)ACETICACID

2566190

AMNIOACETICAMIDENBENZYLOXYCARBONYLNACETICACID

BENZYLOXYCARBONYLGLYCYLGLYCINE

CARBOBENZOXYGLYCYLGLYCINE

CARBOBENZOXYGLYGLY

CBZGLYCYLGLYCINE

GLYCINEN((PHENYLMETHOXY)CARBONYL)GLYCYL

GLYCINEN(N((PHENYLMETHOXY)CARBONYL)GLYCYL)

N((BENZYLOXY)CARBONYL)GLYCYLGLYCINE

NBENZYLOXYCARBONYLGLYCYLGLYCINE

NCARBOBENZOXYGLYCYLGLYCINE

NCBZGLYCYLGLYCINE

C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)O

InChI=1SC12H14N2O5c1510(13711(16)17)61412(18)1989421359h15H68H2(H1315)(H1418)(H1617)


BBL000546
Synonyms: 2,6-bis[(dimethylamino)methyl]pyridin-3-ol
Smiles: CN(Cc1ccc(c(n1)CN(C)C)O)C

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CN(Cc1ccc(c(n1)CN(C)C)O)C

ZINC393981

2168174

26BIS((DIMETHYLAMINO)METHYL)3PYRIDINOL

26BIS((DIMETHYLAMINO)METHYL)PYRIDIN3OL

26BIS(DIMETHYLAMINOMETHYL)PYRIDIN3OL

CN(C)CC1=NC(=C(C=C1)O)CN(C)C

InChI=1SC11H19N3Oc113(2)795611(15)10(129)814(3)4h5615H78H214H3


BBL000547
Synonyms: 2-(naphthalen-2-yloxy)butanoicacid
Smiles: CCC(C(=O)O)Oc1ccc2c(c1)cccc2

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CCC(C(=O)O)Oc1ccc2c(c1)cccc2

161904616

2(2NAPHTHYLOXY)BUTANOICACID

2(NAPHTHALEN2YLOXY)BUTANOICACID

2(NAPHTHALEN2YLOXY)BUTYRICACID

2NAPHTHALEN2YLOXYBUTANOICACID

BUTANOICACID2(2NAPHTHALENYLOXY)(R)

CCC(C(=O)O)OC1=CC2=CC=CC=C2C=C1

InChI=1SC14H14O3c1213(14(15)16)17128710534611(10)912h3913H2H21H3(H1516)


BBL000548
Synonyms: 6-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)c1sc2n(n1)cnn2

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COc1ccc(cc1)c1sc2n(n1)cnn2

438474749

6(4METHOXYPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE

METHYL4(124)TRIAZOLO(34B)(134)THIADIAZOL6YLPHENYLETHER

ZINC03249311

ZINC3249311

COC1=CC=C(C=C1)C2=NN3C=NN=C3S2

InChI=1SC10H8N4OSc1158427(358)913146111210(14)169h26H1H3


BBL000549
Synonyms: 4-amino-5-tert-butyl-4H-1,2,4-triazole-3-thiol
Smiles: CC(c1nnc(n1N)S)(C)C

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CC(c1nnc(n1N)S)(C)C

ZINC03277783

ZINC3277783

4AMINO3TERTBUTYL1H124TRIAZOLE5THIONE

4AMINO5TERTBUTYL124TRIAZOLE3THIOL

4AMINO5TERTBUTYL4H124TRIAZOLE3THIOL

73396584

CC(C)(C)C1=NNC(=S)N1N

InChI=1SC6H12N4Sc16(23)4895(11)10(4)7h7H213H3(H911)


BBL000550
Synonyms: 6-(3-fluorophenyl)-3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Fc1cccc(c1)c1nn2c(s1)nnc2C

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Fc1cccc(c1)c1nn2c(s1)nnc2C

6(3FLUOROPHENYL)3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

880071783

ZINC02338847

ZINC2338847

CC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)F

InChI=1SC10H7FN4Sc1612131015(6)149(1610)73248(11)57h25H1H3


BBL000551
Synonyms: 6-(3-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1cccc(c1)c1nn2c(s1)nnc2

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Clc1cccc(c1)c1nn2c(s1)nnc2

6(3CHLOROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE

876884321

MFCD06599484

ZINC000002218968

ZINC02218968

ZINC2218968

C1=CC(=CC(=C1)Cl)C2=NN3C=NN=C3S2

InChI=1SC9H5ClN4Sc1073126(47)81314511129(14)158h15H


BBL000552
Synonyms: 5-(ethylsulfonyl)-1,3,4-thiadiazol-2-amine
Smiles: CCS(=O)(=O)c1nnc(s1)N

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CCS(=O)(=O)c1nnc(s1)N

ZINC12111573

5(ETHYLSULFONYL)134THIADIAZOL2AMINE

5(ETHYLSULFONYL)134THIADIAZOL2YLAMINE

5(ETHYLSULFONYL)134THIADIAZOLE2YLAMINE

57615302

5ethylsulfonyl134thiadiazol2amine

CCS(=O)(=O)C1=NN=C(S1)N

InChI=1SC4H7N3O2S2c1211(89)4763(5)104h2H21H3(H256)


BBL000553
Synonyms: 4-amino-5-(1H-benzimidazol-1-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Nn1c(S)nnc1Cn1cnc2c1cccc2

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Nn1c(S)nnc1Cn1cnc2c1cccc2

ZINC000006494061

ZINC6494061

MFCD05882948

4AMINO3(BENZIMIDAZOL1YLMETHYL)1H124TRIAZOLE5THIONE

4AMINO5(1HBENZIMIDAZOL1YLMETHYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(1HBENZIMIDAZOL1YLMETHYL)4H124TRIAZOLE3THIOL

5((1HBENZO(D)IMIDAZOL1YL)METHYL)4AMINO4H124TRIAZOLE3THIOL

791806332

C1=CC=C2C(=C1)N=CN2CC3=NNC(=S)N3N

InChI=1SC10H10N6Sc11169(131410(16)17)515612731248(7)15h146H511H2(H1417)


BBL000554
Synonyms: 6-(4-bromophenyl)-3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Brc1ccc(cc1)c1nn2c(s1)nnc2C

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Brc1ccc(cc1)c1nn2c(s1)nnc2C

3METHYL6(4BROMOPHENYL)STRIAZOLO(34B)(134)THIADIAZOLE

6(4BROMOPHENYL)3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE

925641630

MFCD09055755

ZINC000016648196

ZINC16648196

CC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)Br

InChI=1SC10H7BrN4Sc1612131015(6)149(1610)7248(11)537h25H1H3


BBL000555
Synonyms: 4-amino-5-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Smiles: CC(Cc1nnc(n1N)S)C

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CC(Cc1nnc(n1N)S)C

31821713

4AMINO5(2METHYLPROPYL)4H124TRIAZOLE3THIOL

4AMINO5ISOBUTYL24DIHYDRO(124)TRIAZOLE3THIONE

4AMINO5ISOBUTYL4H124TRIAZOLE3THIOL

ZINC09280295

ZINC9280295

4amino3(2methylpropyl)1H124triazole5thione

CC(C)CC1=NNC(=S)N1N

InChI=1SC6H12N4Sc14(2)35896(11)10(5)7h4H37H212H3(H911)


BBL000556
Synonyms: 4-amino-5-(3-fluorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Fc1cccc(c1)c1nnc(n1N)S

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Fc1cccc(c1)c1nnc(n1N)S

ZINC2635301

124980069

4AMINO3(3FLUOROPHENYL)1H124TRIAZOLE5THIONE

4AMINO5(3FLUOROPHENYL)124TRIAZOLE3THIOL

4AMINO5(3FLUOROPHENYL)4H(124)TRIAZOLE3THIOL

4AMINO5(3FLUOROPHENYL)4H124TRIAZOLE3THIOL

C1=CC(=CC(=C1)F)C2=NNC(=S)N2N

InChI=1SC8H7FN4Sc963125(46)711128(14)13(7)10h14H10H2(H1214)


BBL000557
Synonyms: 4-amino-5-(2-fluorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Fc1ccccc1c1nnc(n1N)S

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Fc1ccccc1c1nnc(n1N)S

ZINC3361036

4AMINO3(2FLUOROPHENYL)1H124TRIAZOLE5THIONE

4AMINO5(2FLUOROPHENYL)124TRIAZOLE3THIOL

4AMINO5(2FLUOROPHENYL)4H(124)TRIAZOLE3THIOL

4AMINO5(2FLUOROPHENYL)4H124TRIAZOLE3THIOL


BBL000558
Synonyms: 3-(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)phenol
Smiles: Oc1cccc(c1)c1nnc(n1N)S

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Oc1cccc(c1)c1nnc(n1N)S

ZINC000002392113

ZINC2392113

4AMINO5(3HYDROXYPHENYL)24DIHYDRO3H124TRIAZOLE3THIONE

223919219

3(4AMINO5MERCAPTO4H124TRIAZOL3YL)PHENOL

3(4AMINO5SULFANYL4H124TRIAZOL3YL)PHENOL

MFCD02258412

4amino3(3hydroxyphenyl)1H124triazole5thione

C1=CC(=CC(=C1)O)C2=NNC(=S)N2N

InChI=1SC8H8N4OSc9127(10118(12)14)52136(13)45h1413H9H2(H1114)


BBL000559
Synonyms: 4-chloro-1-(2,3-dihydro-1,4-benzodioxin-6-yl)butan-1-one
Smiles: ClCCCC(=O)c1ccc2c(c1)OCCO2

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ClCCCC(=O)c1ccc2c(c1)OCCO2

ZINC03865400

ZINC3865400

1(2H3HBENZO(34E)14DIOXIN6YL)4CHLOROBUTAN1ONE

4CHLORO1(23DIHYDRO14BENZODIOXIN6YL)BUTAN1ONE

4CHLORO1(23DIHYDROBENZO(14)DIOXIN6YL)BUTAN1ONE

59922008

C1COC2=C(O1)C=CC(=C2)C(=O)CCCCl

InChI=1SC12H13ClO3c1351210(14)9341112(89)16761511h348H1257H2


BBL000560
Synonyms: 4-amino-5-(4-methoxybenzyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)Cc1nnc(n1N)S

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COc1ccc(cc1)Cc1nnc(n1N)S

ZINC01300621

ZINC1300621

3H124TRIAZOLE3THIONE4AMINO24DIHYDRO5((4METHOXYPHENYL)METHYL)

4AMINO3((4METHOXYPHENYL)METHYL)1H124TRIAZOLE5THIONE

4AMINO5((4METHOXYPHENYL)METHYL)124TRIAZOLE3THIOL

4AMINO5((4METHOXYPHENYL)METHYL)4H124TRIAZOLE3THIOL

4AMINO5(4METHOXYBENZYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(4METHOXYBENZYL)4H124TRIAZOLE3THIOL

93073144

COC1=CC=C(C=C1)CC2=NNC(=S)N2N

InChI=1SC10H12N4OSc1158427(358)69121310(16)14(9)11h25H611H21H3(H1316)


BBL000561
Synonyms: N-[3-(benzylamino)propyl]pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)NCCCNCc1ccccc1

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O=C(c1ccncc1)NCCCNCc1ccccc1

ZINC1902962

431056198

N(3(BENZYLAMINO)PROPYL)4PYRIDYLCARBOXAMIDE

N(3(BENZYLAMINO)PROPYL)PYRIDINE4CARBOXAMIDE

N(3BENZYLAMINOPROPYL)ISONICOTINAMIDE

C1=CC=C(C=C1)CNCCCNC(=O)C2=CC=NC=C2

InChI=1SC16H19N3Oc2016(157111712815)1910491813145213614h1358111218H491013H2(H1920)


BBL000562
Synonyms: 2-amino-N-[3-(morpholin-4-yl)propyl]benzamide
Smiles: O=C(c1ccccc1N)NCCCN1CCOCC1

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O=C(c1ccccc1N)NCCCN1CCOCC1

ZINC000020267959

ZINC20267959

MFCD00118395

13666712

2AMINON(3(MORPHOLIN4YL)PROPYL)BENZAMIDE

2AMINON(3MORPHOLIN4YLPROPYL)BENZAMIDE

2AMINON(3MORPHOLINOPROPYL)BENZAMIDE

BENZAMIDE2AMINON(3(4MORPHOLINYL)PROPYL)

C1COCCN1CCCNC(=O)C2=CC=CC=C2N

InChI=1SC14H21N3O2c1513521412(13)14(18)16637178101911917h1245H361115H2(H1618)


BBL000563
Synonyms: 4-amino-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazole-3-thiol
Smiles: Nn1c(CSc2ccccc2)nnc1S

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Nn1c(CSc2ccccc2)nnc1S

ZINC8400889

178169409

4AMINO5((PHENYLSULFANYL)METHYL)4H124TRIAZOLE3THIOL

4AMINO5((PHENYLTHIO)METHYL)4H124TRIAZOLE3THIOL

4amino3(phenylsulfanylmethyl)1H124triazole5thione

C1=CC=C(C=C1)SCC2=NNC(=S)N2N

InChI=1SC9H10N4S2c10138(11129(13)14)6157421357h15H610H2(H1214)


BBL000564
Synonyms: 4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OC)c1nnc(n1N)S

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COc1cc(ccc1OC)c1nnc(n1N)S

MFCD01166530

ZINC000006556077

ZINC06556077

ZINC6556077

125866628

3H124TRIAZOLE3THIONE4AMINO5(34DIMETHOXYPHENYL)24DIHYDRO

4AMINO3(34DIMETHOXYPHENYL)1H124TRIAZOLE5THIONE

4AMINO5(34DIMETHOXYPHENYL)124TRIAZOLE3THIOL

4AMINO5(34DIMETHOXYPHENYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(34DIMETHOXYPHENYL)2H124TRIAZOLE3THIONE

4AMINO5(34DIMETHOXYPHENYL)3MERCAPTO(4H)124TRIAZOLE

4AMINO5(34DIMETHOXYPHENYL)4H(124)TRIAZOLE3THIOL

4AMINO5(34DIMETHOXYPHENYL)4H124TRIAZOL3THIOL

4AMINO5(34DIMETHOXYPHENYL)4H124TRIAZOLE3THIOL

COC1=C(C=C(C=C1)C2=NNC(=S)N2N)OC

InChI=1SC10H12N4O2Sc1157436(58(7)162)9121310(17)14(9)11h35H11H212H3(H1317)


BBL000565
Synonyms: 2,3-dihydro-1H-isoindole
Smiles: N1Cc2c(C1)cccc2

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N1Cc2c(C1)cccc2

ZINC4111883

DIHYDROISOINDOLE

13DIHYDRO2HISOINDOLE

13DIHYDROISOINDOLE

1HISOINDOLE23DIHYDRO

23DIHYDRO1HISOINDOLE

2AZAINDAN

496128

ISOINDOLINE

C1C2=CC=CC=C2CN1

InChI=1SC8H9Nc12486957(8)31h149H56H2


BBL000566
Synonyms: 5-(pyridin-2-yl)-1,3,4-oxadiazole-2-thiol
Smiles: Sc1nnc(o1)c1ccccn1

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Sc1nnc(o1)c1ccccn1

ZINC5771478

3690479

5(2PYRIDINYL)134OXADIAZOLE2THIOL

5(PYRIDIN2YL)134OXADIAZOLE2THIOL

5MERCAPTO2(PYRID2YL)134OXADIAZOLE

5PYRIDIN2YL(134)OXADIAZOLE2THIOL

5PYRIDIN2YL134OXADIAZOLE2THIOL

5PYRIDIN2YL3H134OXADIAZOLE2THIONE

C1=CC=NC(=C1)C2=NNC(=S)O2

InChI=1SC7H5N3OSc1271096(117)5312485h14H(H1012)


BBL000567
Synonyms: 4-amino-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1N)CCc1ccccc1

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Sc1nnc(n1N)CCc1ccccc1

ZINC000020158858

ZINC20158858

MFCD10689949

4AMINO5(2PHENYLETHYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(2PHENYLETHYL)4H124TRIAZOL3YLHYDROSULFIDE

4AMINO5(2PHENYLETHYL)4H124TRIAZOLE3THIOL

4AMINO5PHENETHYL4H124TRIAZOLE3THIOL

93073177

4amino3(2phenylethyl)1H124triazole5thione

C1=CC=C(C=C1)CCC2=NNC(=S)N2N

InChI=1SC10H12N4Sc11149(121310(14)15)768421358h15H6711H2(H1315)


BBL000568
Synonyms: 5-(pyrazin-2-yl)-1,3,4-oxadiazole-2-thiol
Smiles: Sc1nnc(o1)c1cnccn1

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Sc1nnc(o1)c1cnccn1

ZINC2392098

134OXADIAZOLE2(3H)THIONE5(2PYRAZINYL)

134OXADIAZOLE2(3H)THIONE5PYRAZINYL

37545394

5(PYRAZIN2YL)134OXADIAZOL2THIOL

5(PYRAZIN2YL)134OXADIAZOLE2THIOL

5(PYRAZIN2YL)23DIHYDRO134OXADIAZOLE2THIONE

5(PYRAZIN2YL)3H134OXADIAZOLE2THIONE

5PYRAZIN2YL(134)OXADIAZOLE2THIOL

5PYRAZIN2YL134OXADIAZOLE2THIOL

5PYRAZIN2YL3H(134)OXADIAZOLE2THIONE

5PYRAZIN2YL3H134OXADIAZOLE2THIONE

5PYRAZINYL134OXADIAZOLE2THIONE

C1=CN=C(C=N1)C2=NNC(=S)O2

InChI=1SC6H4N4OSc1261095(116)4371284h13H(H1012)


BBL000569
Synonyms: 4-(5-sulfanyl-4H-1,2,4-triazol-3-yl)phenol
Smiles: Oc1ccc(cc1)c1nnc([nH]1)S

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Oc1ccc(cc1)c1nnc((nH)1)S

4(5sulfanyl4H124triazol3yl)phenol

3414968


BBL000570
Synonyms: 4-amino-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Nn1c(S)nnc1c1cnccn1

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Nn1c(S)nnc1c1cnccn1

ZINC2392111

124991691

4AMINO3MERCAPTO5PYRAZINE4(H)124TRIAZOLE

4AMINO3PYRAZIN2YL1H124TRIAZOLE5THIONE

4AMINO5(PYRAZIN2YL)124TRIAZOLE3THIOL

4AMINO5(PYRAZIN2YL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(PYRAZIN2YL)4H124TRIAZOLE3THIOL

4AMINO5PYRAZIN2YL124TRIAZOLE3THIOL

4AMINO5PYRAZIN2YL4H124TRIAZOLE3THIOL

4H124TRIAZOLE3THIOL4AMINO5PYRAZINYL

C1=CN=C(C=N1)C2=NNC(=S)N2N

InChI=1SC6H6N6Sc7125(10116(12)13)4381294h13H7H2(H1113)


BBL000571
Synonyms: 3-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenol
Smiles: Oc1cccc(c1)c1nnc(o1)S

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Oc1cccc(c1)c1nnc(o1)S

ZINC000001605604

ZINC1605604

MFCD00806253

299465126

3(5MERCAPTO(134)OXADIAZOL2YL)PHENOL

3(5MERCAPTO134OXADIAZOL2YL)PHENOL

3(5SULFANYL134OXADIAZOL2YL)PHENOL

5(3HYDROXYPHENYL)134OXADIAZOLE2(3H)THIONE

5(3HYDROXYPHENYL)3H134OXADIAZOLE2THIONE

C1=CC(=CC(=C1)O)C2=NNC(=S)O2

InChI=1SC8H6N2O2Sc1163125(46)79108(13)127h1411H(H1013)


BBL000572
Synonyms: 5-oxo-1-(pyridin-2-ylmethyl)pyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)Cc1ccccn1

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OC(=O)C1CC(=O)N(C1)Cc1ccccn1

ZINC000004478365

ZINC000004478366

MFCD06804433

3PYRROLIDINECARBOXYLICACID5OXO1(2PYRIDINYLMETHYL)

5OXO1((PYRIDIN2YL)METHYL)PYRROLIDINE3CARBOXYLICACID

5OXO1(2PYRIDINYLMETHYL)3PYRROLIDINE

5OXO1(2PYRIDINYLMETHYL)3PYRROLIDINECARBOXYLICACID

5OXO1(2PYRIDYLMETHYL)PYRROLIDINE3CARBOXYLICACID

5OXO1(PYRIDIN2YLMETHYL)PYRROLIDINE3CARBOXYLICACID

5OXO1PYRIDIN2YLMETHYLPYRROLIDINE3CARBOXYLICACID

845546250

C1C(CN(C1=O)CC2=CC=CC=N2)C(=O)O

InChI=1SC11H12N2O3c141058(11(15)16)613(10)793124129h148H57H2(H1516)


BBL000573
Synonyms: 5-(1H-benzimidazol-1-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc([nH]1)Cn1cnc2c1cccc2

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Sc1nnc((nH)1)Cn1cnc2c1cccc2

ZINC000020159004

ZINC20159004

MFCD11868890

1093854819

5((1HBENZO(D)IMIDAZOL1YL)METHYL)4H124TRIAZOLE3THIOL

5(1HBENZIMIDAZOL1YLMETHYL)24DIHYDRO3H124TRIAZOLE3THIONE

5(1HBENZIMIDAZOL1YLMETHYL)4H124TRIAZOL3YLHYDROSULFIDE

5(1HBENZIMIDAZOL1YLMETHYL)4H124TRIAZOLE3THIOL

5(benzimidazol1ylmethyl)12dihydro124triazole3thione

C1=CC=C2C(=C1)N=CN2CC3=NC(=S)NN3

InChI=1SC10H9N5Sc1610129(131410)515611731248(7)15h146H5H2(H212131416)


BBL000574
Synonyms: 5-(3-fluorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Fc1cccc(c1)c1nnc([nH]1)S

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Fc1cccc(c1)c1nnc((nH)1)S

ZINC20158932

306298828

5(3FLUOROPHENYL)4H124TRIAZOLE3THIOL

5(3fluorophenyl)12dihydro124triazole3thione

C1=CC(=CC(=C1)F)C2=NC(=S)NN2

InChI=1SC8H6FN3Sc963125(46)7108(13)12117h14H(H210111213)


BBL000575
Synonyms: (2-amino-5-chlorophenyl)(2-chlorophenyl)methanone
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1Cl)N

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Clc1ccc(c(c1)C(=O)c1ccccc1Cl)N

METHANONE(2AMINO5CHLOROPHENYL)(2CHLOROPHENYL)

ZINC00056397

ZINC56397

(2AMINO5CHLOROPHENYL)(2CHLOROPHENYL)METHANONE

(2AZANYL5CHLORANYLPHENYL)(2CHLOROPHENYL)METHANONE

2958363

2AMINO25DICHLOROBENZOPHENONE

2AMINO52DICHLOROBENZOPHENONE

2AMINO5CHLORO2CHLOROBENZOPHENONE

2AMINO5CHLOROBENZOYL2CHLOROBENZENE

2AMINO5CHLOROPHENYL2CHLOROPHENYLKETONE

4CHLORO2(2CHLOROBENZOYL)ANILINE

BENZOPHENONE2AMINO25DICHLORO

C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)Cl

InChI=1SC13H9Cl2NOc1485612(16)10(78)13(17)9312411(9)15h17H16H2


BBL000576
Synonyms: 4-amino-3-phenylbutanoicacid
Smiles: NCC(c1ccccc1)CC(=O)O

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NCC(c1ccccc1)CC(=O)O

PHENYLGABA

PHENYLGAM

PHENYLGAMMA

ZINC000000052604

ZINC000000052605

MFCD00456233

(S)4AMINO3PHENYLBUTANOICACID

3060411

3AMINO2PHENYLPROPANECARBOXYLICACID

4AMINO3PHENYBUTYRICACID

4AMINO3PHENYLBUTANOICACID

4AMINO3PHENYLBUTYRICACID

4AMINO3PHENYLBUTYRICACIDHYDROCHLORIDE

4AMMONIO3PHENYLBUTANOATE

BENZENEPROPANOICACIDBETA(AMINOMETHYL)

BETA(AMINOMETHYL)BENZENEPROPANOICACID

BETA(AMINOMETHYL)HYDROCINNAMICACID

BETAPHENYLGAMMAAMINOBUTYRATE

BETAPHENYLGAMMAAMINOBUTYRICACID

BUTYRICACID4AMINO3PHENYL

4azaniumyl3phenylbutanoate

C1=CC=C(C=C1)C(CC(=O)(O))C(NH3+)

InChI=1SC10H13NO2c1179(610(12)13)8421358h159H6711H2(H1213)


BBL000577
Synonyms: 4-[(diethylamino)methyl]benzoicacid
Smiles: CCN(Cc1ccc(cc1)C(=O)O)CC

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CCN(Cc1ccc(cc1)C(=O)O)CC

ZINC00548526

ZINC548526

4((DIETHYLAMINO)METHYL)BENZOICACID

4((DIETHYLAMMONIO)METHYL)BENZOATE

4((DIETHYLAZANIUMYL)METHYL)BENZOATE

4(DIETHYLAMINOMETHYL)BENZOICACID

4DIETHYLAMINOMETHYLBENZOICACID

62642595

CC(NH+)(CC)CC1=CC=C(C=C1)C(=O)(O)

InChI=1SC12H17NO2c1313(42)9105711(8610)12(14)15h58H349H212H3(H1415)


BBL000578
Synonyms: N-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]glycine
Smiles: O=C(CN1C(=O)c2c(C1=O)cccc2)NCC(=O)O

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O=C(CN1C(=O)c2c(C1=O)cccc2)NCC(=O)O

PHTHALOYLGLYCYLGLYCINE

ZINC1655960

GLYCINEN((13DIHYDRO13DIOXO2HISOINDOL2YL)ACETYL)

N((13DIHYDRO13DIOXO2HISOINDOL2YL)ACETYL)GLYCINE

N((13DIOXO13DIHYDRO2HISOINDOL2YL)ACETYL)GLYCINE

NPHTHALOYLGLYCYLGLYCINE

(((13DIOXO13DIHYDRO2HISOINDOL2YL)ACETYL)AMINO)ACETICACID

(2(13DIOXO13DIHYDROISOINDOL2YL)ACETYLAMINO)ACETICACID

(2(13DIOXOISOINDOL2YL)ACETAMIDO)ACETICACID

2((2(13DIOXOISOINDOL2YL)ACETYL)AMINO)ACETICACID

2(2(13DIOXO23DIHYDRO1HISOINDOL2YL)ACETAMIDO)ACETICACID

2(2(13DIOXOISOINDOLIN2YL)ACETAMIDO)ACETICACID

3916403

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NCC(=O)O

InChI=1SC12H10N2O5c159(13510(16)17)61411(18)731248(7)12(14)19h14H56H2(H1315)(H1617)


BBL000579
Synonyms: N-[(benzyloxy)carbonyl]phenylalanine
Smiles: O=C(NC(C(=O)O)Cc1ccccc1)OCc1ccccc1

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O=C(NC(C(=O)O)Cc1ccccc1)OCc1ccccc1

ZDLPHENYLALANINE

DLPHENYLALANINEN((PHENYLMETHOXY)CARBONYL)

2(((BENZYLOXY)CARBONYL)AMINO)3PHENYLPROPANOICACID

2(BENZYLOXYCARBONYLAMINO)3PHENYLPROPANOICACID

2BENZYLOXYCARBONYLAMINO3PHENYLPROPIONICACID

3588576

3PHENYL2((PHENYLMETHOXY)CARBONYLAMINO)PROPANOICACID

3PHENYL2(PHENYLMETHOXYCARBONYLAMINO)PROPANOICACID

N((BENZYLOXY)CARBONYL)PHENYLALANINE

NBENZYLOXYCARBONYLDL3PHENYLALANINE

NBENZYLOXYCARBONYLDLPHENYLALANINE

NCARBOBENZOXYDLPHENYLALANINE

NCBZDLPHENYLALANINE

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI=1SC17H17NO4c1916(20)15(11137314813)1817(21)22121495261014h11015H1112H2(H1821)(H1920)


BBL000580
Synonyms: cyclohexyl(hydroxy)phenylaceticacid
Smiles: OC(=O)C(c1ccccc1)(C1CCCCC1)O

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OC(=O)C(c1ccccc1)(C1CCCCC1)O

PHENYLCYCLOHEXYLGLYCOLICACID

2CYCLOHEXYL2HYDROXY2PHENYLACETICACID

2CYCLOHEXYLMANDELICACID

4335777

ACIDEPHENYLCYCLOHEXYLHYDROXYACETIQUE

ACIDEPHENYLCYCLOHEXYLHYDROXYACETIQUE(FRENCH)

ACYCLOHEXYLAHYDROXYPHENYLACETICACID

ACYCLOHEXYLMANDELICACID

ALPHACYCLOHEXYLALPHAHYDROXYBENZENEACETICACID

ALPHACYCLOHEXYLDLMANDELICACID

ALPHACYCLOHEXYLMANDELICACID

ALPHACYCLOHEXYLPHENYLGLYCOLICACID

ALPHAPHENYLCYCLOHEXANEGLYCOLICACID

BENZENEACETICACIDACYCLOHEXYLAHYDROXY

BENZENEACETICACIDALPHACYCLOHEXYLALPHAHYDROXY

BENZENEACETICACIDALPHACYCLOHEXYLALPHAHYDROXY(9CI)

CYCLOHEXANEGLYCOLICACIDALPHAPHENYL

CYCLOHEXYL(HYDROXY)PHENYLACETICACID

CYCLOHEXYLHYDROXYPHENYLACETICACID

CYCLOHEXYLMANDELICACID

CYCLOHEXYLPHENYLGLYCOLICACID

HEXAHYDROBENZILICACID

()CYCLOHEXYLPHENYLGLYCOLICACID

(AS)ALPHAHYDROXYALPHACYCLOHEXYLBENZENEACETICACID

LESPEDAMINE

C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)O)O

InChI=1SC14H18O3c1513(16)14(17117314811)1295261012h134781217H256910H2(H1516)


BBL000581
Synonyms: (2-amino-5-nitrophenyl)(phenyl)methanone
Smiles: Nc1ccc(cc1C(=O)c1ccccc1)[N+](=O)[O-]

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Nc1ccc(cc1C(=O)c1ccccc1)(N+)(=O)(O)

ZINC03861498

ZINC3861498

METHANONE(2AMINO5NITROPHENYL)PHENYL

(2AMINO5NITROPHENYL)(PHENYL)METHANONE

(2AMINO5NITROPHENYL)PHENYLMETHANONE

1775957

2AMINO5NITROBENZOPHENONE

2AMINO5NITROPHENYLPHENYLKETONE

2BENZOYL4NITROANILINE

5NITRO2AMINOBENZOPHENONE

BENZOPHENONE2AMINO5NITRO

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)(N+)(=O)(O))N

InChI=1SC13H10N2O3c14127610(15(17)18)811(12)13(16)9421359h18H14H2


BBL000582
Synonyms: 2,2'-{hexane-1,6-diylbis[nitrilo(E)methylylidene]}diphenol
Smiles: Oc1ccccc1/C=N/CCCCCC/N=C/c1ccccc1O

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Oc1ccccc1C=NCCCCCCN=Cc1ccccc1O

22(hexane16diylbis(nitrilo(E)methylylidene))diphenol

4081350


BBL000583
Synonyms: 4-amino-5-(4-chlorobenzyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)Cc1nnc(n1N)S

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Clc1ccc(cc1)Cc1nnc(n1N)S

4AMINO5(4CHLOROBENZYL)4H124TRIAZOLE3THIOL

93073155

ZINC26475757

4amino3((4chlorophenyl)methyl)1H124triazole5thione

C1=CC(=CC=C1CC2=NNC(=S)N2N)Cl

InChI=1SC9H9ClN4Sc107316(247)5812139(15)14(8)11h14H511H2(H1315)


BBL000584
Synonyms: 4-amino-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1N)CN1CCOCC1

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Sc1nnc(n1N)CN1CCOCC1

ZINC36242282

155219059

4AMINO5(MORPHOLIN4YLMETHYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(MORPHOLIN4YLMETHYL)4H124TRIAZOLE3THIOL

4AMINO5(MORPHOLINOMETHYL)4H124TRIAZOLE3THIOL

4amino3(morpholin4ylmethyl)1H124triazole5thione

C1COCCN1CC2=NNC(=S)N2N

InChI=1SC7H13N5OSc8126(9107(12)14)51113134211h158H2(H1014)


BBL000585
Synonyms: methylN-benzyl-N-methyl-beta-alaninate
Smiles: COC(=O)CCN(Cc1ccccc1)C

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COC(=O)CCN(Cc1ccccc1)C

17946019

3(BENZYLMETHYLAMINO)PROPIONICACIDMETHYLESTER

3(METHYLBENZYLAMINO)PROPANOICACIDMETHYLESTER

METHYL3(BENZYL(METHYL)AMINO)PROPANOATE

METHYLNBENZYLNMETHYLBETAALANINATE

MFCD00454706

ZINC000000343486

ZINC343486

CN(CCC(=O)OC)CC1=CC=CC=C1

InChI=1SC12H17NO2c113(9812(14)152)10116435711h37H810H212H3


BBL000586
Synonyms: [benzyl(methyl)amino]acetonitrile
Smiles: CN(Cc1ccccc1)CC#N

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CN(Cc1ccccc1)CC#N

NBENZYLNMETHYLAMINOACETONITRILE

ZINC19518855

(BENZYL(METHYL)AMINO)ACETONITRILE

(BENZYLMETHYLAMINO)ACETONITRILE

(NMETHYLBENZYLAMINO)ACETONITRILE

14321256

2(BENZYL(METHYL)AMINO)ACETONITRILE

2(NBENZYLNMETHYLAMINO)ACETONITRILE

CN(CC#N)CC1=CC=CC=C1

InChI=1SC10H12N2c112(8711)9105324610h26H89H21H3


BBL000587
Synonyms: 3-(4-methylpiperazin-1-yl)propanenitrile
Smiles: CN1CCN(CC1)CCC#N

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CN1CCN(CC1)CCC#N

N(2CYANOETHYL)NMETHYLPIPERAZINE

ZINC19502505

1(2CYANOETHYL)4METHYLPIPERAZINE

1PIPERAZINEPROPANENITRILE4METHYL

3(4METHYLPIPERAZIN1YL)PROPANENITRILE

3(4METHYLPIPERAZIN1YL)PROPIONITRILE

3(4METHYLPIPERAZINYL)PROPANENITRILE

4491923

4METHYL1PIPERAZINEPROPANENITRILE

InChI=1SC8H15N3c1105711(8610)4239h248H21H3


BBL000588
Synonyms: 15-bromopentadecan-1-ol
Smiles: OCCCCCCCCCCCCCCCBr

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OCCCCCCCCCCCCCCCBr

ZINC000003882165

ZINC03882165

ZINC3882165

MFCD00482036

15BROMANYLPENTADECAN1OL

15BROMO1PENTADECANOL

15BROMOPENTADECAN1OL

15BROMOPENTADECANE1OL

15BROMOPENTADECANOL

1PENTADECANOL15BROMO

59101278

C(CCCCCCCO)CCCCCCCBr

InChI=1SC15H31BrOc1614121086421357911131517h17H115H2


BBL000589
Synonyms: N-(3-aminopropyl)pyridine-2-carboxamide
Smiles: NCCCNC(=O)c1ccccn1

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NCCCNC(=O)c1ccccn1

PYRIDINE2CARBOXYLICACID(3AMINOPROPYL)AMIDE

ZINC4299009

799250343

N(3AMINOPROPYL)2PYRIDYLCARBOXAMIDE

N(3AMINOPROPYL)PYRIDINE2CARBOXAMIDE

C1=CC=NC(=C1)C(=O)NCCCN

InChI=1SC9H13N3Oc10537129(13)84126118h1246H35710H2(H1213)


BBL000590
Synonyms: 4-amino-5-(piperidin-1-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1N)CN1CCCCC1

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Sc1nnc(n1N)CN1CCCCC1

ZINC36242299

155219060

4AMINO5(PIPERIDIN1YLMETHYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(PIPERIDIN1YLMETHYL)4H124TRIAZOLE3THIOL

4AMINO5(PIPERIDINOMETHYL)4H124TRIAZOLE3THIOL

4amino3(piperidin1ylmethyl)1H124triazole5thione

C1CCN(CC1)CC2=NNC(=S)N2N

InChI=1SC8H15N5Sc9137(10118(13)14)6124213512h169H2(H1114)


BBL000591
Synonyms: (phenylsulfanyl)aceticacid
Smiles: OC(=O)CSc1ccccc1

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OC(=O)CSc1ccccc1

PHENYLMERCAPTOACETICACID

PHENYLSULFANYLACETICACID

PHENYLTHIOACETICACID

PHENYLTHIOGLYCOLICACID

SPHENYLMERCAPTOACETICACID

SPHENYLTHIOGLYCOLICACID

THIOPHENOXYACETICACID

ZINC000000084918

ZINC84918

(PHENYLMERCAPTO)ACETICACID

(PHENYLMERCAPTO)ACETICACIDSPHENYLTHIOGLYCOLICACIDTHIOPHENOXYACETICACID

(PHENYLSULFANYL)ACETICACID

(PHENYLTHIO)ACETICACID

2(PHENYLSULFANYL)ACETICACID

2(PHENYLTHIO)ACETICACID

2MERCAPTO2PHENYLACETICACID

2PHENYLSULFANYLACETICACID

708532

ACETICACID(PHENYLTHIO)

ALPHA(PHENYLTHIO)ACETICACID

CARBOXYMETHYLPHENYLSULFIDE

MFCD00004355

C1=CC=C(C=C1)SCC(=O)O

InChI=1SC8H8O2Sc98(10)6117421357h15H6H2(H910)


BBL000592
Synonyms: 2,3-dihydroimidazo[2,1-b][1,3]benzothiazol-6-amine
Smiles: Nc1cc2c(cc1)sc1=NCCn21

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Nc1cc2c(cc1)sc1=NCCn21

ZINC66032

IMIDAZO(21B)BENZOTHIAZOL6AMINE23DIHYDRO

12DIHYDROIMIDAZO(21B)(13)BENZOTHIAZOL7AMINE

23DIHYDROIMIDAZO(21B)(13)BENZOTHIAZOL6AMINE

23DIHYDROIMIDAZO(21B)BENZOTHIAZOL6AMINE

4HYDRO2IMIDAZOLINO(21B)BENZOTHIAZOLE6YLAMINE

78291993

C1CN2C3=C(C=CC(=C3)N)SC2=N1

InChI=1SC9H9N3Sc1061287(56)1243119(12)138h125H3410H2


BBL000593
Synonyms: 4-amino-5-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccc(cc1)c1nnc(n1N)S

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Cc1ccc(cc1)c1nnc(n1N)S

ZINC00058202

ZINC58202

13229011

3H124TRIAZOLE3THIONE4AMINO24DIHYDRO5(4METHYLPHENYL)

4AMINO3(4METHYLPHENYL)1H124TRIAZOLE5THIONE

4AMINO3MERCAPTO5(PTOLYL)(124)TRIAZOLE

4AMINO5(4METHYLPHENYL)124TRIAZOLE3THIOL

4AMINO5(4METHYLPHENYL)4H124TRIAZOL3YLHYDROSULFIDE

4AMINO5(4METHYLPHENYL)4H124TRIAZOLE3THIOL

4AMINO5(PTOLYL)124TRIAZOLE3THIOL

4AMINO5(PTOLYL)4H124TRIAZOLE3THIOL

4AMINO5PTOLYL4H(124)TRIAZOLE3THIOL

4H124TRIAZOLE3THIOL4AMINO5(4METHYLPHENYL)

CC1=CC=C(C=C1)C2=NNC(=S)N2N

InChI=1SC9H10N4Sc16247(536)811129(14)13(8)10h25H10H21H3(H1214)


BBL000594
Synonyms: 4-amino-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cccc(c1)c1nnc(n1N)S

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Cc1cccc(c1)c1nnc(n1N)S

ZINC5981752

105576601

3H124TRIAZOLE3THIONE4AMINO24DIHYDRO5(3METHYLPHENYL)

4AMINO3(3METHYLPHENYL)1H124TRIAZOLE5THIONE

4AMINO5(3METHYLPHENYL)124TRIAZOLE3THIOL

4AMINO5(3METHYLPHENYL)34DIHYDRO2H124TRIAZOLE3THIONE

4AMINO5(3METHYLPHENYL)4H124TRIAZOLE3THIOL

4AMINO5MTOLYL4H(124)TRIAZOLE3THIOL

CC1=CC=CC(=C1)C2=NNC(=S)N2N

InChI=1SC9H10N4Sc163247(56)811129(14)13(8)10h25H10H21H3(H1214)


BBL000595
Synonyms: [(4-methylphenyl)sulfanyl]aceticacid
Smiles: OC(=O)CSc1ccc(cc1)C

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OC(=O)CSc1ccc(cc1)C

PTOLYLSULFANYLACETICACID

ZINC000000343061

ZINC343061

MFCD00034675

((4METHYLPHENYL)SULFANYL)ACETICACID

((4METHYLPHENYL)SULPHANYL)ACETICACID

((4METHYLPHENYL)THIO)ACETICACID

(4METHYLPHENYLTHIO)ACETICACID

(4METHYPHENYLTHIO)ACETICACID

(PTOLYLTHIO)ACETICACID

2((4METHYLPHENYL)SULFANYL)ACETICACID

2(4METHYLPHENYL)SULFANYLACETICACID

2(4METHYLPHENYLTHIO)ACETICACID

2(PTOLYLTHIO)ACETICACID

3996290

4((CARBOXYMETHYL)SULPHANYL)TOLUENE

4METHYLPHENYLTHIOACETIC

4METHYLPHENYLTHIOACETICACID

CC1=CC=C(C=C1)SCC(=O)O

InChI=1SC9H10O2Sc17248(537)1269(10)11h25H6H21H3(H1011)


BBL000596
Synonyms: 4,4'-(1,1-dioxido-3H-2,1-benzoxathiole-3,3-diyl)diphenol
Smiles: Oc1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O

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Oc1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O

PHENOL4(3H21BENZOXATHIOL3YLIDENE)BISSSDIOXIDE

PHENOL4(3H21BENZOXATHIOL3YLIDENE)DISSDIOXIDE

PHENOL44(11DIOXIDO3H21BENZOXATHIOL3YLIDENE)BIS

PHENOL44(3H21BENZOXATHIOL3YLIDENE)BIS(SSDIOXIDE)

PHENOL44(3H21BENZOXATHIOL3YLIDENE)BISSSDIOXIDE

PHENOL44(3H21BENZOXATHIOL3YLIDENE)BISSSDIOXIDE(9CI)

PHENOL44(3H21BENZOXATHIOL3YLIDENE)DISSDIOXIDE

PHENOLRED

4(3(4HYDROXYPHENYL)11DIOXO21L(6)BENZOXATHIOL3YL)PHENOL

44(11DIOXIDO3H21BENZOXATHIOLE33DIYL)DIPHENOL

44(3H21BENZOXATHIOL3YLIDENE)BISPHENOLSSDIOXIDE

44(3H21BENZOXATHIOL3YLIDENE)DIPHENOLSSDIOXIDE

ALPHAHYDROXYALPHAALPHABIS(PHYDROXYPHENYL)OTOLUENESULFONICACIDGAMMASULTONE

MFCD00003552

143748

33BIS(4HYDROXYPHENYL)3H21EBENZOXATHIOLE11DIONE

PHENOLREDACS

PHENOLREDACSREAGENT

PHENOLREDINDICATOR

PHENOLREDPSP

PHENOLREDRECRYSTALLIZED

PHENOLREDSOLUTION

PHENOLSULFONEPHTHALEIN

PHENOLSULFONPHTHALEIN

PHENOLSULFONPHTHALEIN(BANJAN)

PHENOLSULFONPHTHALEIN(JP16NF)

PHENOLSULFONPHTHALEIN(TN)

PHENOLSULPHONPHTHALEIN

PHENOSULFOPHTHALEIN

SULFONPHTHAL

SULPHONTHAL

ZINC000003860918

ZINC03860918

ZINC3860918

33BIS(4HYDROXYPHENYL)BENZO(C)12OXATHIOLENE11DIONE

33BIS(PHYDROXYPHENYL)3H21BENZOXATHIOLE11DIOXIDE

3H21BENZOXATHIOLE33BIS(4HYDROXYPHENYL)11DIOXIDE

3H233BIS(4HYDROXYPHENYL)11DIOXIDE

4(3(4HYDROXYPHENYL)11DIOXO21

4(3(4hydroxyphenyl)11dioxo21$l^(6)benzoxathiol3yl)phenol

C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

InChI=1SC19H14O5Sc20159513(61015)19(1471116(21)12814)17312418(17)25(2223)2419h1122021H


BBL000597
Synonyms: N-(4-chloro-2-methylphenyl)-N-(methylsulfonyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)C)c1ccc(cc1C)Cl

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OC(=O)CN(S(=O)(=O)C)c1ccc(cc1C)Cl

ZINC2578331

N(4CHLORO2METHYLPHENYL)N(METHYLSULFONYL)GLYCINE

((4CHLORO2METHYLPHENYL)METHANESULFONYLAMINO)ACETICACID

(N(4CHLORO2METHYLPHENYL)METHANESULFONAMIDO)ACETICACID

2((4CHLORO2METHYLPHENYL)(METHYLSULFONYL)AMINO)ACETICACID

2(4CHLORO2METHYLNMETHYLSULFONYLANILINO)ACETICACID

2(N(4CHLORO2METHYLPHENYL)METHANESULFONAMIDO)ACETICACID

425625270

CC1=C(C=CC(=C1)Cl)N(CC(=O)O)S(=O)(=O)C

InChI=1SC10H12ClNO4Sc1758(11)349(7)12(610(13)14)17(215)16h35H6H212H3(H1314)


BBL000598
Synonyms: N-(5-chloro-2-methylphenyl)-N-(methylsulfonyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)C)c1cc(Cl)ccc1C

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OC(=O)CN(S(=O)(=O)C)c1cc(Cl)ccc1C

ZINC4982882

METHYLPHENYL)METHANESULFONAMIDO)ACETICACID

N(5CHLORO2METHYLPHENYL)N(METHYLSULFONYL)GLYCINE

((5CHLORO2METHYLPHENYL)METHANESULFONYLAMINO)ACETICACID

(N(5CHLORO2METHYLPHENYL)METHANESULFONAMIDO)ACETICACID

2((5CHLORO2METHYLPHENYL)(METHYLSULFONYL)AMINO)ACETICACID

2(5CHLORO2METHYLNMETHYLSULFONYLANILINO)ACETICACID

2(N(5CHLORO2

362715182

CC1=C(C=C(C=C1)Cl)N(CC(=O)O)S(=O)(=O)C

InChI=1SC10H12ClNO4Sc17348(11)59(7)12(610(13)14)17(215)16h35H6H212H3(H1314)


BBL000599
Synonyms: 2-[(4-methylphenyl)sulfanyl]propanoicacid
Smiles: CC(C(=O)O)Sc1ccc(cc1)C

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CC(C(=O)O)Sc1ccc(cc1)C

MFCD06380365

ZINC000000572048

ZINC000000572049

(2R)2(4METHYLPHENYL)SULFANYLPROPANOATE

17431980

2((4METHYLPHENYL)SULFANYL)PROPANOICACID

2((4METHYLPHENYL)THIO)PROPANOICACID

2(4METHYLPHENYL)SULFANYLPROPANOICACID

2(4METHYLPHENYLTHIO)PROPANOICACID

2(PTOLYLTHIO)PROPANOICACID

CC1=CC=C(C=C1)SC(C)C(=O)O

InChI=1SC10H12O2Sc17359(647)138(2)10(11)12h368H12H3(H1112)


BBL000600
Synonyms: N-(2-phenylethyl)-N-[(2,4,6-trimethylphenyl)sulfonyl]glycine
Smiles: OC(=O)CN(S(=O)(=O)c1c(C)cc(cc1C)C)CCc1ccccc1

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OC(=O)CN(S(=O)(=O)c1c(C)cc(cc1C)C)CCc1ccccc1

ZINC2848290

((MESITYLSULFONYL)(2PHENYLETHYL)AMINO)ACETICACID

2(PHENETHYL(246TRIMETHYLPHENYL)SULFONYLAMINO)ACETICACID

702650257

N(2PHENYLETHYL)N((246TRIMETHYLPHENYL)SULFONYL)GLYCINE

2(2phenylethyl(246trimethylphenyl)sulfonylamino)aceticacid

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)O)C

InChI=1SC19H23NO4Sc1141115(2)19(16(3)1214)25(2324)20(1318(21)22)109177546817h481112H91013H213H3(H2122)


BBL000601
Synonyms: 4-[methyl(methylsulfonyl)amino]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N(S(=O)(=O)C)C

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OC(=O)c1ccc(cc1)N(S(=O)(=O)C)C

ZINC000002165056

ZINC2165056

MFCD00025055

200393686

4(METHYL(METHYLSULFONYL)AMINO)BENZOICACID

4(NMETHYLMETHANESULFONAMIDO)BENZOICACID

4(NMETHYLMETHYLSULFONAMIDO)BENZOICACID

CN(C1=CC=C(C=C1)C(=O)O)S(=O)(=O)C

InChI=1SC9H11NO4Sc110(15(213)14)8537(468)9(11)12h36H12H3(H1112)


BBL000602
Synonyms: 2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1CC(=O)NC(=S)N1

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O=C1CC(=O)NC(=S)N1

THIOBARBITURATE

THIOBARBITURICACID

ZINC08727446

ZINC8727446

2SULFANYLIDENE13DIAZINANE46DIONE

2SULFANYLIDENEDIHYDROPYRIMIDINE46(1H5H)DIONE

2SULFANYLPYRIMIDINE46(1H5H)DIONE

2THIO46DIOXYPYRIMIDINE

2THIOBARBITURICACID

2THIOBARBITURICACID46DIHYDROXYPYRIMIDINE2THIOL

2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE

2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE

2THIOXOHEXAHYDROPYRIMIDINE46DIONE

45H)PYRIMIDINEDIONE2MERCAPTO

45H)PYRIMIDINEDIONEDIHYDRO2THIOXO

46(1H5H)PYRIMIDINEDIONE2MERCAPTO

46(1H5H)PYRIMIDINEDIONEDIHYDRO2THIOXO

46DIHYDROXY2THIOPYRIMIDINE

46DIHYDROXY5HPYRIMIDINE2THIONE

504176

BARBITURICACID2THIO

BARBITURICACID2THIO(VAN)

BARBITURICACID2THIO(VAN)(8CI)

BATHYRAN

2MERCAPTO46DIHYDROXYPYRIMIDINE(VAN)

2MERCAPTOBARBITURICACID

DIHYDRO2THIOXO46(1H5H)PYRIMIDINEDIONE

C1C(=O)NC(=S)NC1=O

InChI=1SC4H4N2O2Sc7213(8)64(9)52h1H2(H256789)


BBL000603
Synonyms: 2-(1H-benzimidazol-2-ylsulfanyl)propanoicacid
Smiles: OC(=O)C(Sc1nc2c([nH]1)cccc2)C

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OC(=O)C(Sc1nc2c((nH)1)cccc2)C

PROPANOICACID2(1HBENZIMIDAZOL2YLTHIO)

2(1H13BENZODIAZOL2YLSULFANYL)PROPANOICACID

2(1HBENZIMIDAZOL2YLSULFANYL)PROPANOICACID

2(1HBENZIMIDAZOL2YLTHIO)PROPANOICACID

2(1HBENZOIMIDAZOL2YLSULFANYL)PROPANOICACID

2(1HBENZOIMIDAZOL2YLSULFANYL)PROPIONICACID

21547706

2BENZIMIDAZOL2YLTHIOPROPANOICACID

CC(C(=O)O)SC1=NC2=CC=CC=C2N1

InChI=1SC10H10N2O2Sc16(9(13)14)151011742358(7)1210h26H1H3(H1112)(H1314)


BBL000604
Synonyms: (tert-butylamino)(oxo)aceticacid
Smiles: O=C(C(=O)O)NC(C)(C)C

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O=C(C(=O)O)NC(C)(C)C

ZINC4312753

N(TERTBUTYL)METHANECARBOXYLICACID

NTERTBUTYLOXALAMICACID

NTERTBUTYLOXAMIDICACID

(TERTBUTYLAMINO)(OXO)ACETICACID

(TERTBUTYLCARBAMOYL)FORMICACID

169772252

2(TERTBUTYLAMINO)2OXOACETICACID

CC(C)(C)NC(=O)C(=O)O

InChI=1SC6H11NO3c16(23)74(8)5(9)10h13H3(H78)(H910)


BBL000605
Synonyms: (cyclohexylamino)(oxo)aceticacid
Smiles: O=C(C(=O)O)NC1CCCCC1

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O=C(C(=O)O)NC1CCCCC1

ZINC11535759

NCYCLOHEXYLOXALAMICACID

NCYCLOHEXYLOXAMIDICACID

(CYCLOHEXYLAMINO)(OXO)ACETICACID

(CYCLOHEXYLCARBAMOYL)FORMICACID

13144622

2(CYCLOHEXYLAMINO)2OXOACETICACID

ACETICACID2(CYCLOHEXYLAMINO)2OXO

C1CCC(CC1)NC(=O)C(=O)O

InChI=1SC8H13NO3c107(8(11)12)96421356h6H15H2(H910)(H1112)


BBL000606
Synonyms: [(2-methylphenyl)amino](oxo)aceticacid
Smiles: OC(=O)C(=O)Nc1ccccc1C

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OC(=O)C(=O)Nc1ccccc1C

OMETHYLOXANILICACID

ZINC2571635

N(2METHYLPHENYL)OXAMIDICACID

NOTOLYLOXALAMICACID

((2METHYLPHENYL)AMINO)(OXO)ACETICACID

((2METHYLPHENYL)CARBAMOYL)FORMICACID

2(2METHYLANILINO)2OXOACETICACID

2OXO2(OTOLYLAMINO)ACETICACID

406190098

CC1=CC=CC=C1NC(=O)C(=O)O

InChI=1SC9H9NO3c1642357(6)108(11)9(12)13h25H1H3(H1011)(H1213)


BBL000607
Synonyms: [(4-methylphenyl)amino](oxo)aceticacid
Smiles: O=C(C(=O)O)Nc1ccc(cc1)C

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O=C(C(=O)O)Nc1ccc(cc1)C

ZINC3127682

N(4METHYLPHENYL)METHANECARBOXYLICACID

N(4METHYLPHENYL)OXAMIDICACID

((4METHYLPHENYL)AMINO)(OXO)ACETICACID

((4METHYLPHENYL)CARBAMOYL)FORMICACID

2(4METHYLANILINO)2OXOACETICACID

2OXO2(PTOLYLAMINO)ACETICACID

42868893

CC1=CC=C(C=C1)NC(=O)C(=O)O

InChI=1SC9H9NO3c16247(536)108(11)9(12)13h25H1H3(H1011)(H1213)


BBL000608
Synonyms: 1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
Smiles: O=Cc1cc(n(c1C)c1ccc(cc1C)C)C

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O=Cc1cc(n(c1C)c1ccc(cc1C)C)C

ZINC00453466

ZINC453466

1(24DIMETHYLPHENYL)25DIMETHYL1HPYRROLE3CARBALDEHYDE

1(24DIMETHYLPHENYL)25DIMETHYLPYRROLE3CARBALDEHYDE

328028871

CC1=CC(=C(C=C1)N2C(=CC(=C2C)C=O)C)C

InChI=1SC15H17NOc1105615(11(2)710)1612(3)814(917)13(16)4h59H14H3


BBL000609
Synonyms: 1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
Smiles: CCc1ccc(cc1)n1c(C)cc(c1C)C=O

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CCc1ccc(cc1)n1c(C)cc(c1C)C=O

ZINC00333946

ZINC333946

1(4ETHYLPHENYL)25DIMETHYL1HPYRROLE3

1(4ETHYLPHENYL)25DIMETHYL1HPYRROLE3CARBALDEHYDE

1(4ETHYLPHENYL)25DIMETHYLPYRROLE3CARBALDEHYDE

426216560

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=O)C

InChI=1SC15H17NOc14135715(8613)1611(2)914(1017)12(16)3h510H4H213H3


BBL000610
Synonyms: 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]piperidine-3-carboxylicacid
Smiles: CCOc1ccc(cc1S(=O)(=O)N1CCCC(C1)C(=O)O)Cl

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CCOc1ccc(cc1S(=O)(=O)N1CCCC(C1)C(=O)O)Cl

1((5CHLORO2ETHOXYPHENYL)SULFONYL)PIPERIDINE3CARBOXYLICACID

1(5CHLORO2ETHOXYPHENYL)SULFONYLPIPERIDINE3CARBOXYLICACID

3PIPERIDINECARBOXYLICACID1((5CHLORO2ETHOXYPHENYL)SULFONYL)

915908575

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCC(C2)C(=O)O

InChI=1SC14H18ClNO5Sc1221126511(15)813(12)22(1920)1673410(916)14(17)18h56810H2479H21H3(H1718)


BBL000611
Synonyms: 3-(3,4-dimethoxyphenyl)propan-1-amine
Smiles: NCCCc1ccc(c(c1)OC)OC

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NCCCc1ccc(c(c1)OC)OC

ZINC2981238

14773423

3(34DIMETHOXYPHENYL)1PROPANAMINE

3(34DIMETHOXYPHENYL)PROPAN1AMINE

3(34DIMETHOXYPHENYL)PROPYLAMINE

34DIMETHOXYBENZENEPROPANAMINE

3AMINO(34DIMETHOXYPHENYL)PROPANE

BENZENEPROPANAMINE34DIMETHOXY

COC1=C(C=C(C=C1)CCCN)OC

InChI=1SC11H17NO2c11310659(43712)811(10)142h568H34712H212H3


BBL000612
Synonyms: 3-(4-methylphenyl)propan-1-amine
Smiles: NCCCc1ccc(cc1)C

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NCCCc1ccc(cc1)C

ZINC9245904

3(4METHYLPHENYL)1PROPANAMINE

3(4METHYLPHENYL)PROPAN1AMINE

3(4METHYLPHENYL)PROPANAMINE

3(PTOLYL)PROPAN1AMINE

3PTOLYLPROPAN1AMINE

3PTOLYLPROPYLAMINE

4METHYLBENZENEPROPANAMINE

54930391

BENZENEPROPANAMINE4METHYL

CC1=CC=C(C=C1)CCCN

InChI=1SC10H15Nc194610(759)32811h47H23811H21H3


BBL000613
Synonyms: 2-(tert-butylsulfanyl)ethanamine
Smiles: NCCSC(C)(C)C

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NCCSC(C)(C)C

ZINC2510156

2(TERTBUTLYTHIO)ETHYLAMINE

2(TERTBUTYLSULFANYL)ETHAN1AMINE

2(TERTBUTYLSULFANYL)ETHANAMINE

2(TERTBUTYLTHIO)ETHANAMINE

2(TERTBUTYLTHIO)ETHANAMINE95

2(TERTBUTYLTHIO)ETHYLAMINE

2TERTBUTYLSULFANYLETHANAMINE

2TERTBUTYLSULFANYLETHYLAMINE

60116770

CC(C)(C)SCCN

InChI=1SC6H15NSc16(23)8547h457H213H3


BBL000614
Synonyms: 2-(cyclohexylsulfanyl)ethanamine
Smiles: NCCSC1CCCCC1

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NCCSC1CCCCC1

ZINC1733124

((2AMINOETHYL)SULFANYL)CYCLOHEXANE

2(CYCLOHEXYLSULFANYL)ETHANAMINE

2(CYCLOHEXYLTHIO)ETHANAMINE

2CYCLOHEXYLSULFANYLETHANAMINE

67215194

C1CCC(CC1)SCCN

InChI=1SC8H17NSc967108421358h8H179H2


BBL000615
Synonyms: 2-(benzylsulfanyl)ethanamine
Smiles: NCCSCc1ccccc1

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NCCSCc1ccccc1

SBENZYLCYSTEAMINE

ZINC1671300

ETHANAMINE2((PHENYLMETHYL)THIO)

1007541

2(BENZYLSULFANYL)ETHAN1AMINE

2(BENZYLSULFANYL)ETHANAMINE

2(BENZYLTHIO)ETHANAMINE

2(BENZYLTHIO)ETHYLAMINE

2BENZYLSULFANYLETHANAMINE

2BENZYLSULFANYLETHYLAMINE

2BENZYLTHIOETHYLAMINE

C1=CC=C(C=C1)CSCCN

InChI=1SC9H13NSc10671189421359h15H6810H2


BBL000616
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1ccc(cc1)Cl

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NCCSCc1ccc(cc1)Cl

ZINC2383483

ETHANAMINE2(((4CHLOROPHENYL)METHYL)THIO)

(2((4CHLOROBENZYL)THIO)ETHYL)AMINE

2(((4CHLOROPHENYL)METHYL)SULFANYL)ETHAN1AMINE

2(((4CHLOROPHENYL)METHYL)SULFANYL)ETHANAMINE

2((4CHLOROBENZYL)SULFANYL)ETHANAMINE

2((4CHLOROBENZYL)THIO)ETHANAMINE

2((4CHLOROPHENYL)METHYLSULFANYL)ETHANAMINE

2((4CHLOROPHENYL)METHYLTHIO)ETHYLAMINE

2(4CHLOROBENZYLSULFANYL)ETHYLAMINE

2(4CHLOROBENZYLTHIO)ETHYLAMINE

60116214

C1=CC(=CC=C1CSCCN)Cl

InChI=1SC9H12ClNSc109318(249)7126511h14H5711H2


BBL000617
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1ccccc1Cl

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NCCSCc1ccccc1Cl

ZINC1668371

ETHANAMINE2(((2CHLOROPHENYL)METHYL)THIO)

(2((2CHLOROBENZYL)THIO)ETHYL)AMINE

2(((2CHLOROPHENYL)METHYL)SULFANYL)ETHAN1AMINE

2(((2CHLOROPHENYL)METHYL)SULFANYL)ETHANAMINE

2((2CHLOROBENZYL)SULFANYL)ETHANAMINE

2((2CHLOROBENZYL)SULPHANYL)ETHYLAMINE

2((2CHLOROBENZYL)THIO)ETHANAMINE

2((2CHLOROBENZYL)THIO)ETHYLAMINE

2((2CHLOROPHENYL)METHYLSULFANYL)ETHANAMINE

2((2CHLOROPHENYL)METHYLTHIO)ETHYLAMINE

2(2CHLOROBENZYLSULFANYL)ETHYLAMINE

2(THIO)ETHYLAMINE

42416239

C1=CC=C(C(=C1)CSCCN)Cl

InChI=1SC9H12ClNSc10942138(9)7126511h14H5711H2


BBL000618
Synonyms: 2-[(4-methylbenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1ccc(cc1)C

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NCCSCc1ccc(cc1)C

ZINC4206146

ETHANAMINE2(((4METHYLPHENYL)METHYL)THIO)

(2((4METHYLBENZYL)THIO)ETHYL)AMINE

106670342

2(((4METHYLPHENYL)METHYL)SULFANYL)ETHAN1AMINE

2((4METHYLBENZYL)SULFANYL)ETHANAMINE

2((4METHYLBENZYL)THIO)ETHANAMINE

2((4METHYLPHENYL)METHYLSULFANYL)ETHANAMINE

CC1=CC=C(C=C1)CSCCN

InChI=1SC10H15NSc192410(539)8127611h25H6811H21H3


BBL000619
Synonyms: ethyl2-amino-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)sc(c1C)C(=O)NC

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CCOC(=O)c1c(N)sc(c1C)C(=O)NC

ETHYL2AMINO4METHYL5((METHYLAMINO)CARBONYL)3THIOPHENECARBOXYLATE

ETHYL2AMINO4METHYL5(METHYLCARBAMOYL)THIOPHENE3CARBOXYLATE

ETHYL2AMINO4METHYL5(NMETHYLCARBAMOYL)THIOPHENE3CARBOXYLATE

2AMINO4METHYL5METHYLCARBAMOYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

735335554

ZINC03319659

ZINC3319659

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)N

InChI=1SC10H14N2O3Sc141510(14)65(2)7(9(13)123)168(6)11h411H213H3(H1213)


BBL000620
Synonyms: 2-[(2-methylbenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1ccccc1C

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NCCSCc1ccccc1C

ZINC19485523

60116430

2(((2METHYLPHENYL)METHYL)SULFANYL)ETHAN1AMINE

2((2METHYLBENZYL)SULFANYL)ETHANAMINE

2((2METHYLBENZYL)THIO)ETHANAMINE

2((2methylphenyl)methylsulfanyl)ethanamine

CC1=CC=CC=C1CSCCN

InChI=1SC10H15NSc19423510(9)8127611h25H6811H21H3


BBL000621
Synonyms: 3-(2-propoxyphenyl)propan-1-amine
Smiles: NCCCc1ccccc1OCCC

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NCCCc1ccccc1OCCC

ZINC20130236

3(2PROPOXYPHENYL)1PROPANAMINE

3(2PROPOXYPHENYL)PROPAN1AMINE

937661897

CCCOC1=CC=CC=C1CCCN

InChI=1SC12H19NOc12101412843611(12)75913h3468H25791013H21H3


BBL000622
Synonyms: 3-(2-ethoxyphenyl)propan-1-amine
Smiles: NCCCc1ccccc1OCC

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NCCCc1ccccc1OCC

ZINC9245908

3(2ETHOXYPHENYL)1PROPANAMINE

3(2ETHOXYPHENYL)PROPAN1AMINE

937653399

CCOC1=CC=CC=C1CCCN

InChI=1SC11H17NOc121311843610(11)75912h3468H257912H21H3


BBL000623
Synonyms: 3-(4-ethoxyphenyl)propan-1-amine
Smiles: NCCCc1ccc(cc1)OCC

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NCCCc1ccc(cc1)OCC

ZINC11596889

3(4ETHOXYPHENYL)1PROPANAMINE

3(4ETHOXYPHENYL)PROPAN1AMINE

36397247

CCOC1=CC=C(C=C1)CCCN

InChI=1SC11H17NOc1213117510(6811)43912h58H24912H21H3


BBL000624
Synonyms: methyl4-amino-3-methylbenzoate
Smiles: COC(=O)c1ccc(c(c1)C)N

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COC(=O)c1ccc(c(c1)C)N

METHYL3METHYL4AMINOBENZOATE

METHYL4AMINO3METHYLBENZENECARBOXYLATE

METHYL4AMINO3METHYLBENZOATE

METHYL4AMINOMTOLUATE

ZINC00153331

ZINC153331

18595147

2AMINO5(METHOXYCARBONYL)TOLUENE

4(METHOXYCARBONYL)2METHYLANILINE

4AMINO3METHYLBENZOICACIDMETHYLESTER

4AMINO3TOLUICACIDMETHYLESTER

4AMINOMTOLUICACIDMETHYLESTER

4METHOXYCARBONYL2METHYLANILINE

CC1=C(C=CC(=C1)C(=O)OC)N

InChI=1SC9H11NO2c1657(9(11)122)348(6)10h35H10H212H3


BBL000625
Synonyms: 4-amino-N-(3-chlorophenyl)benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)Cl

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Nc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)Cl

ZINC03240093

ZINC3240093

((4AMINOPHENYL)SULFONYL)(3CHLOROPHENYL)AMINE

19837811

4AMINON(3CHLOROPHENYL)BENZENESULFONAMIDE

4AMINON(3CHLOROPHENYL)BENZENESULPHONAMIDE

BENZENESULFONAMIDE4AMINON(3CHLOROPHENYL)

C1=CC(=CC(=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)N

InChI=1SC12H11ClN2O2Sc13921311(89)1518(1617)126410(14)5712h1815H14H2


BBL000626
Synonyms: ethyl5-amino-2-chlorobenzoate
Smiles: CCOC(=O)c1cc(N)ccc1Cl

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CCOC(=O)c1cc(N)ccc1Cl

ETHYL5AMINO2CHLOROBENZOATE

64401554

BENZOICACID5AMINO2CHLOROETHYLESTER

ZINC19092739

CCOC(=O)C1=C(C=CC(=C1)N)Cl

InChI=1SC9H10ClNO2c12139(12)756(11)348(7)10h35H211H21H3


BBL000627
Synonyms: ethyl4-amino-3-chlorobenzoate
Smiles: CCOC(=O)c1ccc(c(c1)Cl)N

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CCOC(=O)c1ccc(c(c1)Cl)N

ETHYL3CHLORO4AMINOBENZOATE

ETHYL4AMINO3CHLOROBENZOATE

1AMINO2CHLORO4CARBOETHOXYBENZENE

4AMINO3CHLOROBENZOICACIDETHYLESTER

BENZOICACID4AMINO3CHLOROETHYLESTER

ZINC01437421

ZINC1437421

CCOC(=O)C1=CC(=C(C=C1)N)Cl

InChI=1SC9H10ClNO2c12139(12)6348(11)7(10)56h35H211H21H3


BBL000628
Synonyms: ethyl4-amino-2-chlorobenzoate
Smiles: CCOC(=O)c1ccc(cc1Cl)N

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CCOC(=O)c1ccc(cc1Cl)N

ETHYL2CHLORO4AMINOBENZOATE

ETHYL4AMINO2CHLOROBENZENECARBOXYLATE

ETHYL4AMINO2CHLOROBENZOATE

ETHYL4AMINO2CHLOROBENZOATE95

ETHYLAMINOCHLOROBENZENECARBOXYLATE

16017699

3CHLORO4(ETHOXYCARBONYL)ANILINE

4AMINO2CHLOROBENZOICACIDETHYLESTER

ZINC19092703

CCOC(=O)C1=C(C=C(C=C1)N)Cl

InChI=1SC9H10ClNO2c12139(12)7436(11)58(7)10h35H211H21H3


BBL000629
Synonyms: methyl3-amino-4-methylbenzoate
Smiles: COC(=O)c1ccc(c(c1)N)C

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COC(=O)c1ccc(c(c1)N)C

18595181

3AMINO4METHYLBENZOICACIDMETHYLESTER

3AMINOPTOLUICACIDMETHYLESTER

BENZOICACID3AMINO4METHYLMETHYLESTER

METHYL3AMINO4METHYLBENZOATE

METHYL3AMINO4METHYLBENZOOATE

METHYL3AMINOPTOLUATE

ZINC00152678

ZINC152678

CC1=C(C=C(C=C1)C(=O)OC)N

InChI=1SC9H11NO2c16347(58(6)10)9(11)122h35H10H212H3


BBL000630
Synonyms: 1-(2,4-dimethylphenyl)ethanamine
Smiles: Cc1ccc(c(c1)C)C(N)C

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Cc1ccc(c(c1)C)C(N)C

(S)1(24DIMETHYLPHENYL)ETHANAMINE

1(24DIMETHYLPHENYL)ETHAN1AMINE

1(24DIMETHYLPHENYL)ETHANAMINE

1(24DIMETHYLPHENYL)ETHYLAMINE

102877076

BENZENEMETHANAMINEA24TRIMETHYL(AS)

CC1=CC(=C(C=C1)C(C)N)C

InChI=1SC10H15Nc174510(9(3)11)8(2)67h469H11H213H3


BBL000631
Synonyms: 2-methoxy-5-(piperidin-1-ylsulfonyl)aniline
Smiles: COc1ccc(cc1N)S(=O)(=O)N1CCCCC1

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COc1ccc(cc1N)S(=O)(=O)N1CCCCC1

ZINC03885494

ZINC3885494

2METHOXY5(PIPERIDIN1YLSULFONYL)ANILINE

2METHOXY5(PIPERIDINE1SULFONYL)ANILINE

2METHOXY5(PIPERIDINE1SULFONYL)PHENYLAMINE

2METHOXY5(PIPERIDYLSULFONYL)PHENYLAMINE

2METHOXY5PIPERIDIN1YLSULFONYLANILINE

379255148

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)N

InChI=1SC12H18N2O3Sc117126510(911(12)13)18(1516)147324814h569H247813H21H3


BBL000632
Synonyms: 1-(2,5-dimethylphenyl)ethanamine
Smiles: Cc1ccc(c(c1)C(N)C)C

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Cc1ccc(c(c1)C(N)C)C

()1(25DIMETHYLPHENYL)ETHYLAMINE

1(25DIMETHYLPHENYL)ETHAN1AMINE

1(25DIMETHYLPHENYL)ETHANAMINE

1(25DIMETHYLPHENYL)ETHYLAMINE

91251262

BENZYLAMINEA25TRIMETHYL()

CC1=CC(=C(C=C1)C)C(C)N

InChI=1SC10H15Nc17458(2)10(67)9(3)11h469H11H213H3


BBL000633
Synonyms: 2-[(ethylsulfonyl)amino]benzoicacid
Smiles: CCS(=O)(=O)Nc1ccccc1C(=O)O

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CCS(=O)(=O)Nc1ccccc1C(=O)O

ETHANESULPHONYLAMINOBENZOICACID

ZINC49946756

2((ETHYLSULFONYL)AMINO)BENZOICACID

2((ETHYLSULPHONYL)AMINO)BENZOICACID

2(ETHANESULPHONYLAMINO)BENZOICACID

2(ETHYLSULFONAMIDO)BENZOICACID

2(ETHYLSULFONYLAMINO)BENZOICACID

2ETHANESULFONAMIDOBENZOICACID

923248037

BENZOICACID2((ETHYLSULFONYL)AMINO)

CCS(=O)(=O)NC1=CC=CC=C1C(=O)O

InChI=1SC9H11NO4Sc1215(1314)10864357(8)9(11)12h3610H2H21H3(H1112)


BBL000634
Synonyms: 4-amino-N-(2,5-dimethylphenyl)benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)ccc1C

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Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)ccc1C

ZINC20130420

188357462

4AMINON(25DIMETHYLPHENYL)BENZENESULFONAMIDE

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=CC=C(C=C2)N

InChI=1SC14H16N2O2Sc1103411(2)14(910)1619(1718)137512(15)6813h3916H15H212H3


BBL000635
Synonyms: 4-methyl-3-[(4-methylpiperazin-1-yl)sulfonyl]aniline
Smiles: CN1CCN(CC1)S(=O)(=O)c1cc(N)ccc1C

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CN1CCN(CC1)S(=O)(=O)c1cc(N)ccc1C

4METHYL3((4METHYLPIPERAZIN1YL)SULFONYL)ANILINE

4METHYL3(4METHYLPIPERAZIN1YLSULFONYL)ANILINE

4METHYL3(4METHYLPIPERAZINE1SULFONYL)ANILINE

4METHYL3(4METHYLPIPERAZINE1SULFONYL)PHENYLAMINE

947018964

ZINC35360895

4methyl3(4methylpiperazin1yl)sulfonylaniline

CC1=C(C=C(C=C1)N)S(=O)(=O)N2CCN(CC2)C

InChI=1SC12H19N3O2Sc1103411(13)912(10)18(1617)157514(2)6815h349H5813H212H3


BBL000636
Synonyms: 2-[(3-chlorobenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1cccc(c1)Cl

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NCCSCc1cccc(c1)Cl

ZINC8730092

106670331

2(((3CHLOROPHENYL)METHYL)SULFANYL)ETHAN1AMINE

2(((3CHLOROPHENYL)METHYL)SULFANYL)ETHANAMINE

2((3CHLOROBENZYL)SULFANYL)ETHANAMINE

2((3CHLOROBENZYL)SULFANYL)ETHYLAMINE

2((3CHLOROBENZYL)THIO)ETHANAMINE

2(3CHLOROBENZYLSULFANYL)ETHYLAMINE

3CHLOROBENZYL(2AMINOETHYL)SULFIDE

2((3chlorophenyl)methylsulfanyl)ethanamine

C1=CC(=CC(=C1)Cl)CSCCN

InChI=1SC9H12ClNSc1093128(69)7125411h136H45711H2


BBL000637
Synonyms: 3-(4-methylpiperidin-1-yl)propan-1-amine
Smiles: NCCCN1CCC(CC1)C

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NCCCN1CCC(CC1)C

ZINC2582060

1PIPERIDINEPROPANAMINE4METHYL

3(4METHYL1PIPERIDINYL)1PROPANAMINE

3(4METHYL1PIPERIDINYL)PROPYLAMINE

3(4METHYLPIPERIDIN1YL)PROPAN1AMINE

3(4METHYLPIPERIDIN1YL)PROPYLAMINE

3(4METHYLPIPERIDYL)PROPYLAMINE

6241301

CC1CCN(CC1)CCCN

InChI=1SC9H20N2c193711(849)62510h9H2810H21H3


BBL000638
Synonyms: 4-amino-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(cc(c1OC)OC)c1nnc(n1N)S

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COc1cc(cc(c1OC)OC)c1nnc(n1N)S

ZINC00988403

ZINC988403

31821780

4AMINO3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE

4AMINO3MERCAPTO5(345TRIMETHOXYPHENYL)4H124TRIAZOLE

4AMINO5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL

4AMINO5(345TRIMETHOXYPHENYL)24DIHYDRO3H124TRIAZOLE3THIONE

4AMINO5(345TRIMETHOXYPHENYL)4H(124)TRIAZOLE3THIOL

4AMINO5(345TRIMETHOXYPHENYL)4H124TRIAZOLE3THIOL

COC1=CC(=CC(=C1OC)OC)C2=NNC(=S)N2N

InChI=1SC11H14N4O3Sc116746(58(172)9(7)183)10131411(19)15(10)12h45H12H213H3(H1419)


BBL000639
Synonyms: 1-(4-tert-butylphenyl)ethanamine
Smiles: CC(c1ccc(cc1)C(C)(C)C)N

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CC(c1ccc(cc1)C(C)(C)C)N

MFCD03419831

ZINC000002559440

ZINC000002732103

(R)4TERTBUTYLALPHAMETHYLBENZYLAMINE

(S)4TERTBUTYLALPHAMETHYLBENZYLAMINE

1(4(TERTBUTYL)PHENYL)ETHANAMINE

1(4(TERTBUTYL)PHENYL)ETHYLAMINE

1(4TERTBUTYLPHENYL)ETHAN1AMINE

1(4TERTBUTYLPHENYL)ETHANAMINE

1(4TERTBUTYLPHENYL)ETHYLAMINE

89538658

BENZENEMETHANAMINE4(11DIMETHYLETHYL)AMETHYL

CC(C1=CC=C(C=C1)C(C)(C)C)N

InChI=1SC12H19Nc19(13)105711(8610)12(23)4h59H13H214H3


BBL000640
Synonyms: 2,2-dimethyl-3,4-dihydro-2H-chromen-4-amine
Smiles: NC1CC(C)(C)Oc2c1cccc2

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NC1CC(C)(C)Oc2c1cccc2

(22DIMETHYL34DIHYDRO2HCHROMEN4YL)AMINE

220634413

22DIMETHYL34DIHYDRO1BENZOPYRAN4AMINE

22DIMETHYL34DIHYDRO2H1BENZOPYRAN4AMINE

22DIMETHYL34DIHYDRO2HCHROMEN4AMINE

22DIMETHYL34DIHYDRO2HCHROMEN4AMINE22DIMETHYLCHROMAN4AMINE4AMINO22DIMETHYLCHROMAN

22DIMETHYLCHROMAN4AMINE

22DIMETHYLCHROMAN4YLAMINE

4AMINO22DIMETHYLCHROMAN

4AMINO34DIHYDRO22DIMETHYL2H1BENZOPYRAN

22dimethyl34dihydrochromen4amine

CC1(CC(C2=CC=CC=C2O1)N)C

InChI=1SC11H15NOc111(2)79(12)8534610(8)1311h369H712H212H3


BBL000641
Synonyms: 3-(piperidin-1-yl)propan-1-amine
Smiles: NCCCN1CCCCC1

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NCCCN1CCCCC1

PIPERIDINE1PROPYLAMINE

N(3AMINOPROPYL)PIPERIDINE

N3AMINOPROPYLPIPERIDINE

(3PIPERIDIN1YLPROPYL)AMINE

06083529

PIPERIDINOPROPYLAMINE

ZINC1733260

1(3AMINOPROPYL)PIPERIDINE

1AMINO3(PIPERIDIN1YL)PROPANE

1PIPERIDINEPROPANAMINE

1PIPERIDINEPROPANEAMINE

1PIPERIDINEPROPANEDIAMINE

1PIPERIDINEPROPYLAMINE

3(1PIPERIDINYL)1PROPANAMINE

3(NPIPERADINO)PROPYLAMINE

3(PIPERIDIN1YL)PROPAN1AMINE

3(PIPERIDIN1YL)PROPYLAMINE

3(PIPERIDINE1YL)PROPYLAMINE

3AMINOPROPYLPIPERIDINE

3PIPERIDIN1YLPROPAN1AMINE

3PIPERIDIN1YLPROPYLAMINE

3PIPERIDINE1YLPROPYLAMINE

3PIPERIDINOPROPYLAMINE

3PIPERIDYLPROPYLAMINE

C1CCN(CC1)CCCN

InChI=1SC8H18N2c9548106213710h19H2


BBL000642
Synonyms: 3-(azepan-1-yl)propan-1-amine
Smiles: NCCCN1CCCCCC1

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NCCCN1CCCCCC1

ZINC2163878

1(3AMINOPROPYL)AZACYCLOHEPTANE

1(3AMINOPROPYL)HEXAHYDRO1HAZEPINE

1(3AMINOPROPYL)HOMOPIPERIDINE

1HAZEPINE1PROPANAMINEHEXAHYDRO

3(1AZEPANYL)1PROPANAMINE

3(AZEPAN1YL)PROPAN1AMINE

3437330

3AZAPERHYDROEPINYLPROPYLAMINE

3AZEPAN1YLPROPAN1AMINE

3AZEPAN1YLPROPYLAMINE

3HEXAMETHYLENEIMINO1PROPYLAMINE

AZEPANYLPROPANAMINE

C1CCCN(CC1)CCCN

InChI=1SC9H20N2c106591173124811h110H2


BBL000643
Synonyms: N-ethylhydrazinecarbothioamide
Smiles: CCNC(=S)NN

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CCNC(=S)NN

ETHYLTHIOSEMICARBAZIDE

HYDRAZINECARBOTHIOAMIDENETHYL

(ETHYLAMINO)HYDRAZINOMETHANE1THIONE

13431340

1AMINO3ETHYLTHIOUREA

4ETHYL3THIOSEMICARBAZIDE

4ETHYLTHIOSEMICARBAZIDE

NETHYLHYDRAZINECARBOTHIOAMIDE

SEMICARBAZIDE4ETHYL3THIO

SEMICARBAZIDE4ETHYL3THIO(8CI)

THIOSEMICARBAZIDE4ETHYL

ZINC05447677

ZINC5447677

InChI=1SC3H9N3Sc1253(7)64h24H21H3(H2567)


BBL000644
Synonyms: 2-methoxy-5-(morpholin-4-ylsulfonyl)aniline
Smiles: COc1ccc(cc1N)S(=O)(=O)N1CCOCC1

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COc1ccc(cc1N)S(=O)(=O)N1CCOCC1

ZINC03885490

ZINC3885490

2METHOXY5(MORPHOLIN4YLSULFONYL)ANILINE

2METHOXY5(MORPHOLIN4YLSULFONYL)PHENYLAMINE

2METHOXY5(MORPHOLINE4SULFONYL)ANILINE

2METHOXY5(MORPHOLINE4SULFONYL)PHENYLAMINE

2METHOXY5(MORPHOLINOSULFONYL)ANILINE

2METHOXY5MORPHOLIN4YLSULFONYLANILINE

56807171

BENZENAMINE2METHOXY5(4MORPHOLINYLSULFONYL)

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)N

InChI=1SC11H16N2O4Sc11611329(810(11)12)18(1415)1346177513h238H4712H21H3


BBL000645
Synonyms: [(2-chlorobenzyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCc1ccccc1Cl

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OC(=O)CSCc1ccccc1Cl

OCHLOROBENZYLMERCAPTOACETICACID

ZINC1605508

((2CHLOROBENZYL)SULFANYL)ACETICACID

((2CHLOROBENZYL)THIO)ACETICACID

2(((2CHLOROPHENYL)METHYL)SULFANYL)ACETICACID

2((2CHLOROBENZYL)THIO)ACETICACID

2((2CHLOROPHENYL)METHYLSULFANYL)ACETICACID

66516652

ACETICACID(((2CHLOROPHENYL)METHYL)THIO)

C1=CC=C(C(=C1)CSCC(=O)O)Cl

InChI=1SC9H9ClO2Sc10842137(8)51369(11)12h14H56H2(H1112)


BBL000646
Synonyms: 4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenol
Smiles: Oc1ccc(cc1)c1nnc(o1)S

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Oc1ccc(cc1)c1nnc(o1)S

4(5sulfanyl134oxadiazol2yl)phenol

69829909


BBL000647
Synonyms: 2-methyl-3-(pyrrolidin-1-yl)propan-1-amine
Smiles: NCC(CN1CCCC1)C

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NCC(CN1CCCC1)C

(2METHYL3PYRROLIDIN1YLPROPYL)AMINE

2METHYL3(PYRROLIDIN1YL)PROPAN1AMINE

893644547

2methyl3pyrrolidin1ylpropan1amine

CC(CN)CN1CCCC1

InChI=1SC8H18N2c18(69)710423510h8H279H21H3


BBL000648
Synonyms: 5,5-dimethylcyclohexane-1,3-dione
Smiles: O=C1CC(=O)CC(C1)(C)C

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O=C1CC(=O)CC(C1)(C)C

CYCLOMETHONE

DIMEDON

DIMEDONE

DIMEDONEMETHONE

DIMETHYLDIHYDRORESORCINOL

11DIMETHYL35CYCLOHEXANEDIONE

11DIMETHYL35DIKETOCYCLOHEXANE

ZINC100008249

126818

13CYCLOHEXANEDIONE55DIMETHYL

13DIOXO55DIMETHYLCYCLOHEXANE

155DIMETHYL

15CYCLOHEXANEDIONE

15DIKETOCYCLOHEXANE

53CYCLOHEXANEDIONE

55DIMETHYL13CYCLOHEXADIONE

55DIMETHYL13CYCLOHEXANDIONE

55DIMETHYL13CYCLOHEXANEDIONE

55DIMETHYL13DIHYDRORESORCINOL

55DIMETHYLCYCLOHEXAN13DIONE

55DIMETHYLCYCLOHEXANE13DIONE

55DIMETHYLDIHYDRORESORCINOL

55DIMETHYLHYDRORESORCINOL

CC1(CC(=O)CC(=O)C1)C

InChI=1SC8H12O2c18(2)46(9)37(10)58h35H212H3


BBL000649
Synonyms: 7-(ethylamino)-4,6-dimethyl-2H-chromen-2-one
Smiles: CCNc1cc2oc(=O)cc(c2cc1C)C

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CCNc1cc2oc(=O)cc(c2cc1C)C

COUMARIN2

COUMARIN450

COUMARIN6DIMETHYL

COUMARIN7(ETHYLAMINO)46DIMETHYL

MFCD00006860

ZINC000000266372

ZINC00266372

ZINC266372

26078251

2H1BENZOPYRAN2ONE6DIMETHYL

2H1BENZOPYRAN2ONE7(ETHYLAMINO)46DIMETHYL

46DIMETHYL7(ETHYLAMINO)COUMARIN

46DIMETHYL7ETHYLAMINOCOUMARIN

7(ETHYLAMINO)46DIMETHYL2BENZOPYRONE

7(ETHYLAMINO)46DIMETHYL2HCHROMEN2ONE

7(ETHYLAMINO)46DIMETHYLCHROMEN2ONE

7(ETHYLAMINO)46DIMETHYLCOUMARIN

7ETHYLAMINO46DIMETHYLCHROMEN2ONE

7ETHYLAMINO46DIMETHYLCOUMARIN

CCNC1=C(C=C2C(=CC(=O)OC2=C1)C)C

InChI=1SC13H15NO2c14141171210(59(11)3)8(2)613(15)1612h5714H4H213H3


BBL000650
Synonyms: 2-ethoxypyridine-3-carboxylicacid
Smiles: CCOc1ncccc1C(=O)O

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CCOc1ncccc1C(=O)O

MFCD00128788

ZINC000002582031

ZINC2582031

2ETHOXY3PYRIDINECARBOXYLICACID

2ETHOXYNICOTINICACID

2ETHOXYPYRIDINE3CARBOXYLICACID

35969541

3PYRIDINECARBOXYLICACID2ETHOXY

CCOC1=C(C=CC=N1)C(=O)O

InChI=1SC8H9NO3c121276(8(10)11)43597h35H2H21H3(H1011)


BBL000651
Synonyms: 2-[(furan-2-ylmethyl)sulfanyl]ethanamine
Smiles: NCCSCc1ccco1

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NCCSCc1ccco1

ZINC2572501

ETHANAMINE2((2FURANYLMETHYL)THIO)

(2AMINOETHYLTHIO)METHYLFURAN

2(((2FURANYL)METHYL)THIO)ETHANAMINE

2(((FUR2YL)METHYL)SULPHANYL)ETHYLAMINE

2(((FUR2YL)METHYL)THIO)ETHYLAMINE

2((2AMINOETHYLTHIO)METHYL)FURAN

2((2FURYL)METHYLTHIO)ETHYLAMINE

2((2FURYLMETHYL)SULFANYL)ETHANAMINE

2((FURAN2YLMETHYL)SULFANYL)ETHAN1AMINE

2((FURAN2YLMETHYL)SULFANYL)ETHANAMINE

2(2FURYLMETHYLTHIO)ETHYLAMINE

2(FURAN2YLMETHYLSULFANYL)ETHANAMINE

2(FURAN2YLMETHYLSULFANYL)ETHYLAMINE

2(FURAN2YLMETHYLTHIO)ETHANAMINE

2(FURFURYLTHIO)ETHANAMINE

2(FURFURYLTHIO)ETHYLAMINE

36415211

C1=COC(=C1)CSCCN

InChI=1SC7H11NOSc835106721497h124H3568H2


BBL000652
Synonyms: methyl3-amino-3-(3,4-dimethoxyphenyl)propanoate
Smiles: COC(=O)CC(c1ccc(c(c1)OC)OC)N

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COC(=O)CC(c1ccc(c(c1)OC)OC)N

METHYL3AMINO3(34DIMETHOXYPHENYL)PROPANOATE

METHYL3AMINO3(34DIMETHOXYPHENYL)PROPIONATE

3AMINO3(34DIMETHOXYPHENYL)PROPIONICACIDMETHYLESTER

COC1=C(C=C(C=C1)C(CC(=O)OC)N)OC

InChI=1SC12H17NO4c11510548(611(10)162)9(13)712(14)173h469H713H213H3


BBL000653
Synonyms: 3,4-difluorobenzenecarboximidamide
Smiles: NC(=N)c1ccc(c(c1)F)F

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NC(=N)c1ccc(c(c1)F)F

ZINC1437482

114040505

34DIFLUOROBENZAMIDINE

34DIFLUOROBENZENE1CARBOXIMIDAMIDE

34DIFLUOROBENZENECARBOXIMIDAMIDE

34DIFLUOROBENZIMIDAMIDE

BENZENECARBOXIMIDAMIDE34DIFLUORO

C1=CC(=C(C=C1C(=N)N)F)F

InChI=1SC7H6F2N2c85214(7(10)11)36(5)9h13H(H31011)


BBL000654
Synonyms: (2-amino-6-oxo-1,6-dihydropyrimidin-5-yl)aceticacid
Smiles: Nc1ncc(c(=O)[nH]1)CC(=O)O

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Nc1ncc(c(=O)(nH)1)CC(=O)O

ZINC14001667

(2AMINO4HYDROXYPYRIMIDIN5YL)ACETICACID

(2AMINO4OXO3HPYRIMIDIN5YL)ACETICACID

(2AMINO6OXO16DIHYDRO5PYRIMIDINYL)ACETICACID

(2AMINO6OXO16DIHYDROPYRIMIDIN5YL)ACETICACID

2(2AMINO4HYDROXYPYRIMIDIN5YL)ACETICACID

2(2AMINO4OXO34DIHYDROPYRIMIDINE5YL)ACETICACID

2(2AMINO6OXO16DIHYDROPYRIMIDIN5YL)ACETICACID

5PYRIMIDINEACETICACID2AMINO14DIHYDRO4OXO

5PYRIMIDINEACETICACID2AMINO14DIHYDRO4OXO(9CI)

85301388


BBL000655
Synonyms: 4-amino-N-(3-methoxyphenyl)benzenesulfonamide
Smiles: COc1cccc(c1)NS(=O)(=O)c1ccc(cc1)N

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COc1cccc(c1)NS(=O)(=O)c1ccc(cc1)N

ZINC19259987

19837797

4AMINON(3METHOXYPHENYL)BENZENESULFONAMIDE

4AMINON(3METHOXYPHENYL)BENZENESULPHONAMIDE

COC1=CC=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N

InChI=1SC13H14N2O3Sc1181242311(912)1519(1617)137510(14)6813h2915H14H21H3


BBL000656
Synonyms: 2-[(2-chloro-6-fluorobenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1c(F)cccc1Cl

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NCCSCc1c(F)cccc1Cl

ZINC2510233

ETHANAMINE2(((2CHLORO6FLUOROPHENYL)METHYL)THIO)

(2AMINOETHYL)(2CHLORO6FLUOROBENZYL)SULPHIDE

175136762

2(((2CHLORO6FLUOROPHENYL)METHYL)SULFANYL)ETHAN1

2(((2CHLORO6FLUOROPHENYL)METHYL)SULFANYL)ETHAN1AMINE

2(((2CHLORO6FLUOROPHENYL)METHYL)SULFANYL)ETHANAMINE

2((2CHLORANYL6FLUORANYLPHENYL)METHYLSULFANYL)ETHANAMINE

2((2CHLORO6FLUOROBENZYL)SULFANYL)ETHANAMINE

2((2CHLORO6FLUOROBENZYL)THIO)ETHANAMINE

2((2CHLORO6FLUOROBENZYL)THIO)ETHYLAMINE

2((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)ETHANAMINE

2((2CHLORO6FLUOROPHENYL)METHYLTHIO)ETHANAMINE

2((2CHLORO6FLUOROPHENYL)METHYLTHIO)ETHYLAMINE

2((6CHLORO2FLUOROPHENYL)METHYLTHIO)ETHYLAMINE

2(2CHLORO6FLUOROBENZYLSULFANYL)ETHYLAMINE

2(2CHLORO6FLUOROBENZYLTHIO)ETHANAMIN

2(2CHLORO6FLUOROBENZYLTHIO)ETHANAMINE

2(2CHLORO6FLUOROBENZYLTHIO)ETHYLAMINE

2AMINOETHYL2CHLORO6FLUOROBENZYLSULPHIDE

C1=CC(=C(C(=C1)Cl)CSCCN)F

InChI=1SC9H11ClFNSc1082139(11)7(8)6135412h13H4612H2


BBL000657
Synonyms: 2-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenol
Smiles: Sc1nnc(o1)c1ccccc1O

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Sc1nnc(o1)c1ccccc1O

2(5sulfanyl134oxadiazol2yl)phenol

29638333

MFCD00985283

ZINC000004673267


BBL000658
Synonyms: 3-(3,5-dimethylpiperidin-1-yl)propan-1-amine
Smiles: NCCCN1CC(C)CC(C1)C

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NCCCN1CC(C)CC(C1)C

3(35DIMETHYLPIPERIDIN1YL)PROPAN1AMINE

3(35DIMETHYLPIPERIDIN1YL)PROPYLAMINE

3(35DIMETHYLPIPERIDYL)PROPYLAMINE

878657115

CC1CC(CN(C1)CCCN)C

InChI=1SC10H22N2c19610(2)812(79)53411h910H3811H212H3


BBL000659
Synonyms: 3-(2-ethylpiperidin-1-yl)propan-1-amine
Smiles: NCCCN1CCCCC1CC

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NCCCN1CCCCC1CC

N(3AMINOPROPYL)2ETHYLPIPERIDINE

13901387

1PIPERIDINEPROPANAMINE2ETHYL

2ETHYL1PIPERIDINEPROPANAMINE

3(2ETHYLPIPERIDIN1YL)PROPAN1AMINE

3(2ETHYLPIPERIDIN1YL)PROPYLAMINE

3(2ETHYLPIPERIDINE1YL)PROPYLAMINE

CCC1CCCCN1CCCN

InChI=1SC10H22N2c1210634812(10)95711h10H2911H21H3


BBL000660
Synonyms: 6-oxo-2-(pyridin-3-yl)-1,6-dihydropyrimidine-5-carboxylicacid
Smiles: OC(=O)c1cnc([nH]c1=O)c1cccnc1

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OC(=O)c1cnc((nH)c1=O)c1cccnc1

ZINC000020272790

ZINC20272790

MFCD13370795

4HYDROXY2(PYRIDIN3YL)PYRIMIDINE5CARBOXYLICACID

4OXO2(3PYRIDYL)3HYDROPYRIMIDINE5CARBOXYLICACID

56406463

6OXO2(3PYRIDINYL)16DIHYDRO5PYRIMIDINECARBOXYLICACID

6OXO2(PYRIDIN3YL)16DIHYDROPYRIMIDINE5CARBOXYLICACID

6OXO2PYRIDIN3YL16DIHYDROPYRIMIDINE5CARBOXYLICACID

6oxo2pyridin3yl1Hpyrimidine5carboxylicacid

C1=CC(=CN=C1)C2=NC=C(C(=O)N2)C(=O)O

InChI=1SC10H7N3O3c1497(10(15)16)5128(139)62131146h15H(H1516)(H121314)


BBL000661
Synonyms: 3-methyl-4-propyl-4H-1,2,4-benzothiadiazine-7-carboxylicacid1,1-dioxide
Smiles: CCCN1C(=NS(=O)(=O)c2c1ccc(c2)C(=O)O)C

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CCCN1C(=NS(=O)(=O)c2c1ccc(c2)C(=O)O)C

ZINC36075271

1159694731

3METHYL11DIOXO4PROPYL14DIHYDRO1LAMBDA6BENZO(124)THIADIAZINE7CARBOXYLICACID

3METHYL4PROPYL4H124BENZOTHIADIAZINE7CARBOXYLICACID11DIOXIDE

3methyl11dioxo4propyl1$l^(6)24benzothiadiazine7carboxylicacid

CCCN1C(=NS(=O)(=O)C2=C1C=CC(=C2)C(=O)O)C

InChI=1SC12H14N2O4Sc136148(2)1319(1718)1179(12(15)16)4510(11)14h457H36H212H3(H1516)


BBL000662
Synonyms: 3-methoxy-N-[4-(pyrrolidin-1-yl)benzyl]propan-1-amine
Smiles: COCCCNCc1ccc(cc1)N1CCCC1

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COCCCNCc1ccc(cc1)N1CCCC1

MFCD08741862

ZINC000008733400

ZINC8733400

(3METHOXYPROPYL)(((4(PYRROLIDIN1

3METHOXYN(4(PYRROLIDIN1YL)BENZYL)PROPAN1AMINE

919724451

3methoxyN((4pyrrolidin1ylphenyl)methyl)propan1amine

COCCCNCC1=CC=C(C=C1)N2CCCC2

InChI=1SC15H24N2Oc11812491613145715(8614)1710231117h5816H24913H21H3


BBL000663
Synonyms: 5-(2-chlorophenyl)-1-phenyl-1H-tetrazole
Smiles: Clc1ccccc1c1nnnn1c1ccccc1

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Clc1ccccc1c1nnnn1c1ccccc1

5(2CHLOROPHENYL)1PHENYL1HTETRAZOLE

5(2CHLOROPHENYL)1PHENYLTETRAZOLE

97027402

MFCD00450869

ZINC000000406343

ZINC00406343

ZINC406343

C1=CC=C(C=C1)N2C(=NN=N2)C3=CC=CC=C3Cl

InChI=1SC13H9ClN4c1412954811(12)1315161718(13)106213710h19H


BBL000664
Synonyms: 2,3,5,6-tetrachloropyridin-4-amine
Smiles: Clc1nc(Cl)c(c(c1Cl)N)Cl

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Clc1nc(Cl)c(c(c1Cl)N)Cl

2356tetrachloropyridin4amine

4AMINOTETRACHLOROPYRIDINE

MFCD00183239

TETRACHLOROPYRIDIN4AMINE

ZINC000019791602

ZINC19791602

2176638

C1(=C(C(=NC(=C1Cl)Cl)Cl)Cl)N

InChI=1SC5H2Cl4N2c613(10)2(7)5(9)114(1)8h(H21011)


BBL000665
Synonyms: (2,4-dinitrophenyl)hydrazine
Smiles: NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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NNc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)

ZINC000003860431

ZINC03860431

ZINC3860431

DINITROPHENYLHYDRAZINE

DNPHYDRAZINE

HYDRAZINE(24DINITROPHENYL)

HYDRAZINE4DINITROPHENYL)

(24DINITROPHENYL)HYDRAZINE

1(24DINITROPHENYL)HYDRAZINE

119266

1HYDRAZINE24DINITROBENZENE

1HYDRAZINO24DINITROBENZENE

24DINITROFENYLHYDRAZIN

24DINITROPHEBYLHYDRAZINE

24DINITROPHENYLHYDRAZINE

24DINITROPHENYLHYDRAZINEHYDROCHLORICACIDSOLUTION

24DNPHYDRAZINE

MFCD00007578

C1=CC(=C(C=C1(N+)(=O)(O))(N+)(=O)(O))NN

InChI=1SC6H6N4O4c785214(9(11)12)36(5)10(13)14h138H7H2


BBL000666
Synonyms: 6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine
Smiles: O1CCOc2ccccc2OCCOCCOc2c(OCC1)cccc2

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O1CCOc2ccccc2OCCOCCOc2c(OCC1)cccc2

6791017182021octahydrodibenzo(bk)(147101316)hexaoxacyclooctadecine

14187327

MFCD00005098

CROWNETHERDIBENZO18CROWN6

DIBENZO18CROWN

DIBENZO18CROWN6

DIBENZO18CROWN6ETHER

DIBENZOCROWN

TIN(II)IONOPHOREI

ZINC000003861212

ZINC03861212

ZINC3861212

C1COC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OCCO1

InChI=1SC20H24O6c1261817(51)231392111152519734820(19)2616122210142418h18H916H2


BBL000667
Synonyms: 4-(2,5-dimethoxyphenyl)-4-oxobutanoicacid
Smiles: COc1ccc(cc1C(=O)CCC(=O)O)OC

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COc1ccc(cc1C(=O)CCC(=O)O)OC

GAMMAOXO25DIMETHOXYBENZENEBUTANOICACID

MFCD00089268

ZINC000000396787

ZINC396787

1084748

3(25DIMETHOXYBENZOYL)PROPIONICACID

4(25DIMETHOXYPHENYL)4OXOBUTANOICACID

4(25DIMETHOXYPHENYL)4OXOBUTYRICACID

BENZENEBUTANOICACID25DIMETHOXYAOXO

BENZENEBUTANOICACID25DIMETHOXYGOXO

COC1=CC(=C(C=C1)OC)C(=O)CCC(=O)O

InChI=1SC12H14O5c11683511(172)9(78)10(13)4612(14)15h357H46H212H3(H1415)


BBL000668
Synonyms: 2-bromo-3-nitrobenzoicacid
Smiles: OC(=O)c1cccc(c1Br)[N+](=O)[O-]

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OC(=O)c1cccc(c1Br)(N+)(=O)(O)

ZINC000000330043

ZINC330043

MFCD00074899

2BROMO3NITROBENZOICACID

573546

BENZOICACID2BROMO3NITRO

C1=CC(=C(C(=C1)(N+)(=O)(O))Br)C(=O)O

InChI=1SC7H4BrNO4c864(7(10)11)2135(6)9(12)13h13H(H1011)


BBL000669
Synonyms: 5-nitro-2-(trifluoromethyl)-1H-benzimidazole
Smiles: [O-][N+](=O)c1ccc2c(c1)nc([nH]2)C(F)(F)F

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(O)(N+)(=O)c1ccc2c(c1)nc((nH)2)C(F)(F)F

132502933

1HBENZIMIDAZOLE6NITRO2(TRIFLUOROMETHYL)

2(TRIFLUOROMETHYL)5NITRO1HBENZIMIDAZOLE

2CF35NO2BENZIMADAZOLE

2NITRO4TRIFLUOROMETHYLBENZOICACID

2TRIFLUOROMETHYL5NITROBENZIMIDAZOLE

2TRIFLUROMETHYL5NITROBENZIMIDAZOLE

5NITRO2(TRIFLUOROMETHYL)1H13BENZODIAZOLE

5NITRO2(TRIFLUOROMETHYL)1HBENZIMIDAZOLE

5NITRO2(TRIFLUOROMETHYL)1HBENZO(D)IMIDAZOLE

5NITRO2(TRIFLUOROMETHYL)BENZIMIDAZOL

5NITRO2(TRIFLUOROMETHYL)BENZIMIDAZOLE

5NITRO2TRIFLUOROMETHYL1HBENZOIMIDAZOLE

5NITRO2TRIFLUOROMETHYLBENZIMIDAZOLE

6NITRO2(TRIFLUOROMETHYL)1H13BENZODIAZOLE

6NITRO2(TRIFLUOROMETHYL)1HBENZIMIDAZOLE

6NITRO2TRIFLUOROMETHYL1HBENZOIMIDAZOLE

BENZIMIDAZOLE5NITRO2(TRIFLUOROMETHYL)

ZINC3832614

C1=CC2=C(C=C1(N+)(=O)(O))NC(=N2)C(F)(F)F

InChI=1SC8H4F3N3O2c98(1011)7125214(14(15)16)36(5)137h13H(H1213)


BBL000670
Synonyms: 4,7-dichloro-2-methylquinoline
Smiles: Clc1ccc2c(c1)nc(cc2Cl)C

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Clc1ccc2c(c1)nc(cc2Cl)C

2METHYL47DICHLOROQUINOLINE

47DICHLORO2METHYLQUINOLINE

47DICHLOROQUINALDINE

50593696

MFCD00272366

ZINC000000407933

ZINC00407933

ZINC407933

CC1=NC2=C(C=CC(=C2)Cl)C(=C1)Cl

InChI=1SC10H7Cl2Nc1649(12)8327(11)510(8)136h25H1H3


BBL000671
Synonyms: 4-bromo-1-hydroxynaphthalene-2-carboxylicacid
Smiles: OC(=O)c1cc(Br)c2c(c1O)cccc2

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OC(=O)c1cc(Br)c2c(c1O)cccc2

ZINC000000235999

ZINC235999

MFCD00021504

2NAPHTHALENECARBOXYLICACID4BROMO1HYDROXY

4BROMO1HYDROXY2NAPHTHOICACID

4BROMO1HYDROXYNAPHTHALENE2CARBOXYLICACID

5813376

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)Br

InChI=1SC11H7BrO3c12958(11(14)15)10(13)742136(7)9h1513H(H1415)


BBL000672
Synonyms: 2,2'-sulfinylbis(4,6-dichlorophenol)
Smiles: Clc1cc(Cl)c(c(c1)S(=O)c1cc(Cl)cc(c1O)Cl)O

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Clc1cc(Cl)c(c(c1)S(=O)c1cc(Cl)cc(c1O)Cl)O

MFCD00056677

PHENOL22SULFINYLBIS(46DICHLORO

PHENOL2SULFINYLBIS(46DICHLORO

ZINC000000608214

ZINC608214

2((35DICHLORO2HYDROXYPHENYL)SULFINYL)46DICHLOROPHENOL

2(35BIS(CHLORANYL)2OXIDANYLPHENYL)SULFINYL46BIS(CHLORANYL)PHENOL

22INVERTEDEXCLAMATIONMARKASULFINYLBIS(46DICHLOROPHENOL)

22SULFINYLBIS(46DICHLOROPHENOL)

24DICHLORO6((35DICHLORO2HYDROXYBENZENE)SULFINYL)PHENOL

24DICHLORO6(35DICHLORO2HYDROXYBENZENESULFINYL)PHENOL

24DICHLORO6(35DICHLORO2HYDROXYPHENYL)SULFINYLPHENOL

6((35DICHLORO2HYDROXYPHENYL)SULFINYL)24DICHLOROPHENOL

64DICHLOROPHENOL)

66SULFINYLBIS(24DICHLOROPHENOL)

844268

BIS(2HYDROXY35DICHLOROPHENYL)SULFOXIDE

BIS(35DICHLORO2HYDROXYPHENYL)SULFOXIDE

BITHIONOL(SULFOXIDE)

BITHIONOLSULFOXIDE

C1=C(C=C(C(=C1Cl)O)S(=O)C2=CC(=CC(=C2O)Cl)Cl)Cl

InChI=1SC12H6Cl4O3Sc13517(15)11(17)9(35)20(19)1046(14)28(16)12(10)18h141718H


BBL000673
Synonyms: 6-chloro-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccc2c(c1)oc(=O)[nH]2

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Clc1ccc2c(c1)oc(=O)(nH)2

ZINC95080696

19932844

2(3H)BENZOXAZOLONE6CHLORO

2(3H)BENZOXAZOLONE6CHLORO(9CI)

2BENZOXAZOLINONE6CHLORO

6CHLORO13BENZOXAZOL2(3H)ONE

6CHLORO13BENZOXAZOL2OL

6CHLORO23DIHYDRO13BENZOXAZOL2ONE

6CHLORO23DIHYDROBENZOXAZOL2ONE

6CHLORO2BENZOXAZOLINONE

6CHLORO2BENZOXAZOLONE

6CHLORO2HYDROXYBENZOXAZOLE

6CHLORO3H13BENZOXAZOL2ONE

6CHLORO3HBENZOOXAZOL2ONE

6CHLORO3HYDROBENZOXAZOL2ONE

6CHLOROBENZO(D)OXAZOL2(3H)ONE

6CHLOROBENZOXAZOL2(3H)ONE

6CHLOROBENZOXAZOLIN2ONE

6CHLOROBENZOXAZOLINONE

6CHLOROBENZOXAZOLONE

6CHLOROOXAZONE

C1=CC2=C(C=C1Cl)OC(=O)N2

InChI=1SC7H4ClNO2c841256(34)117(10)95h13H(H910)


BBL000674
Synonyms: 4-chloro-N-ethyl-2-nitroaniline
Smiles: CCNc1ccc(cc1[N+](=O)[O-])Cl

more...



CCNc1ccc(cc1(N+)(=O)(O))Cl

(4CHLORO2NITROPHENYL)ETHYLAMINE

28491954

4CHLORONETHYL2NITROANILINE

ANILINE4CHLORONETHYL2NITRO

BENZENAMINE4CHLORONETHYL2NITRO

N1ETHYL4CHLORO2NITROANILINE

NETHYL4CHLORO2NITROANILINE

ZINC04013023

ZINC4013023

CCNC1=C(C=C(C=C1)Cl)(N+)(=O)(O)

InChI=1SC8H9ClN2O2c12107436(9)58(7)11(12)13h3510H2H21H3


BBL000675
Synonyms: N-(2-nitrophenyl)acetamide
Smiles: CC(=O)Nc1ccccc1[N+](=O)[O-]

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CC(=O)Nc1ccccc1(N+)(=O)(O)

2NITROACETANILIDE

552329

ACETAMIDEN(2NITROPHENYL)

ACETAMIDEN(NITROPHENYL)

ACETANILIDE2NITRO

ACETANILIDE2NITRO(8CI)

MFCD00016991

N(2NITROPHENYL)ACETAMIDE

N(2NITROPHENYL)ETHANAMIDE

N1(2NITROPHENYL)ACETAMIDE

NACETYL2NITROANILINE

OACETYLAMINONITROBENZENE

ONITROACETANILIDE

ONITROACETOANILIDE

ZINC000003958740

ZINC03958740

ZINC3958740

CC(=O)NC1=CC=CC=C1(N+)(=O)(O)

InChI=1SC8H8N2O3c16(11)9742358(7)10(12)13h25H1H3(H911)


BBL000676
Synonyms: 1,3-bis(hydroxymethyl)urea
Smiles: OCNC(=O)NCO

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OCNC(=O)NCO

OXYMETHUREA

UREA13BIS(HYDROXYMETHYL)

UREA13BIS(HYDROXYMETHYL)(8CI)

UREA3BIS(HYDROXYMETHYL)

UREANBIS(HYDROXYMETHYL)

UREANNBIS(HYDROXYMETHYL)

ZINC000001673590

13BIS(HYDROXYMETHYL)HARNSTOFF

13BIS(HYDROXYMETHYL)UREA

ZINC01673590

ZINC1673590

13DIMETHYLOLUREA

140954

CARBAMOL

DIMETHANOLUREA

DIMETHYLOLUREA

DIMETHYLOLUREA90

DIMETHYLOLUREA95

DIMETHYLOLUREATECH

MFCD00014414

N(HYDROXYMETHYL)((HYDROXYMETHYL)AMINO)CARBOXAMIDE

NNBIS(HYDROXYMETHYL)UREA

NNDIHYDROXYMETHYLUREA

NNDIMETHYLOLUREA

C(NC(=O)NCO)O

InChI=1SC3H8N2O3c6143(8)527h67H12H2(H2458)


BBL000677
Synonyms: (2E)-1,3-bis(4-methoxyphenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)c1ccc(cc1)OC

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COc1ccc(cc1)C=CC(=O)c1ccc(cc1)OC

MFCD00025815

ZINC000003894525

ZINC03894525

ZINC3894525

(2E)13BIS(4METHOXYPHENYL)PROP2EN1ONE

(E)13BIS(4METHOXYPHENYL)2PROPEN1ONE

(E)13BIS(4METHOXYPHENYL)PROP2EN1ONE

(E)44DIMETHOXYCHALCONE

13BIS(4METHOXYPHENYL)2PROPEN1ONE

13BIS(4METHOXYPHENYL)PROP2EN1ONE

2373899

2PROPEN1ONE13BIS(4METHOXYPHENYL)

44DIMETHOXYCHALCONE

COC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OC

InChI=1SC17H16O3c119158313(4915)51217(18)1461016(202)11714h312H12H3b125+


BBL000678
Synonyms: 4-hydroxy-6-(phenylamino)naphthalene-2-sulfonicacid
Smiles: Oc1cc(cc2c1cc(cc2)Nc1ccccc1)S(=O)(=O)O

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Oc1cc(cc2c1cc(cc2)Nc1ccccc1)S(=O)(=O)O

PHENYLGAMMAACID

ZINC1648162

GAMMAACIDNPHENYL

NPHENYLGAMMAACID

119197

2ANILINE8HYDROXY6NAPHTHALENESULFONICACID

2ANILINO8NAPHTHOL6SULFONICACID

2NAPHTHALENESULFONICACID4HYDROXY6(PHENYLAMINO)

2NAPHTHALENESULFONICACID4HYDROXY6COUPLEDWITHDIAZOTIZED2METHYL5NITROBENZENESULFONICACIDPPHENYLENEDIAMINEREACTIONPRODUCTSSODIUMSALTS

2NAPHTHALENESULFONICACID6ANILINO4HYDROXY

4HYDROXY6(PHENYLAMINO)2NAPHTHALENESULFONICACID

4HYDROXY6(PHENYLAMINO)NAPHTHALENE2SULFONATE

4HYDROXY6(PHENYLAMINO)NAPHTHALENE2SULFONICACID

6ANILINO4HYDROXY2NAPHTHALENESULFONICACID

6ANILINO4HYDROXYNAPHTHALENE2SULFONICACID

6ANILINO4HYDROXYNAPHTHALENE2SULPHONICACID

7ANILINO1NAPHTHOL3SULFONICACID

C1=CC=C(C=C1)NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)O

InChI=1SC16H13NO4Sc18161014(22(1920)21)8116713(915(11)16)17124213512h1101718H(H192021)


BBL000679
Synonyms: 1-(octylsulfinyl)octane
Smiles: CCCCCCCCS(=O)CCCCCCCC

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CCCCCCCCS(=O)CCCCCCCC

DINOCTYLSULFOXIDE

DIOCTYLSULFOXIDE

(OCTYLSULFINYL)OCTANE

1(OCTANE1SULFINYL)OCTANE

1(OCTYLSULFINYL)OCTANE

11SULPHINYLBISOCTANE

1986896

1OCTYLSULFINYLOCTANE

MFCD00039514

NOCTYLSULFOXIDE

OCTANE1(OCTYLSULFINYL)

OCTYLSULFOXIDE

ZINC000096272028

ZINC96272028

InChI=1SC16H34OSc1357911131518(17)161412108642h316H212H3


BBL000680
Synonyms: 3-[(phenylcarbonyl)oxy]-2,2-bis{[(phenylcarbonyl)oxy]methyl}propylbenzoate
Smiles: O=C(c1ccccc1)OCC(COC(=O)c1ccccc1)(COC(=O)c1ccccc1)COC(=O)c1ccccc1

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O=C(c1ccccc1)OCC(COC(=O)c1ccccc1)(COC(=O)c1ccccc1)COC(=O)c1ccccc1

PENTAERYTHRITOLTETRABENZOATE

PROPANEDIOL(22BIS(BENZOYLOXY)METHYL)DIBENZOATE

ZINC000004015432

ZINC4015432

MFCD00020676

(3(BENZOYLOXY)22BIS(BENZOYLOXYMETHYL)PROPYL)BENZOATE

(3BENZOYLOXY22BIS(BENZOYLOXYMETHYL)PROPYL)BENZOATE

122BIS((BENZOYLOXY)METHYL)DIBENZOATE

13PROPANEDIOL22BIS((BENZOYLOXY)METHYL)13DIBENZOATE

13PROPANEDIOL22BIS((BENZOYLOXY)METHYL)DIBENZOATE

22BIS((BENZOYLOXY)METHYL)13PROPANEDIOLDIBENZOATE

22BIS((BENZOYLOXY)METHYL)DIBENZOATEPROPANEDIOL

22BIS(PHENYLCARBONYLOXYMETHYL)3PHENYLCARBONYLOXYPROPYLBENZOATE

3((PHENYLCARBONYL)OXY)22BIS(((PHENYLCARBONYL)OXY)METHYL)PROPYLBENZOATE

3(BENZOYLOXY)22BIS((BENZOYLOXY)METHYL)PROPYLBENZOATE

4196865

BENZOFLEXS552

BENZOICACIDTETRAESTERWITHPENTAERYTHRITOL

C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)(COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4

InChI=1SC33H28O8c3429(25135161425)382133(223930(35)26157281626234031(36)271793101827)244132(37)2819114122028h120H2124H2


BBL000681
Synonyms: cyclopent-2-en-1-ylpropanedioicacid
Smiles: OC(=O)C(C1CCC=C1)C(=O)O

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OC(=O)C(C1CCC=C1)C(=O)O

ZINC000000031223

ZINC000000031224

CYCLOPENT2EN1YLPROPANEDIOICACID

197455871

2(CYCLOPENT2EN1YL)PROPANEDIOICACID

2CYCLOPENT2EN1YLPROPANEDIOICACID

2CYCLOPENT2ENYLPROPANEDIOICACID

MFCD00019307

C1CC(C=C1)C(C(=O)O)C(=O)O

InChI=1SC8H10O4c97(10)6(8(11)12)531245h1356H24H2(H910)(H1112)


BBL000682
Synonyms: N,N-dimethyl-4-nitroaniline
Smiles: CN(c1ccc(cc1)[N+](=O)[O-])C

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CN(c1ccc(cc1)(N+)(=O)(O))C

DIMETHYL(4NITROPHENYL)AMINE

1(DIMETHYLAMINO)4NITROBENZENE

100232

1DIMETHYLAMINO4NITROBENZENE

4(DIMETHYLAMINO)NITROBENZENE

4NITRODIMETHYLANILINE

4NITRONNDIMETHYLANILINE

ANILINENDIMETHYLPNITRO

ANILINENNDIMETHYLPNITRO

BENZENAMINENDIMETHYL4NITRO

BENZENAMINENNDIMETHYL4NITRO

NNDIMETHYL4NITROANILINE

NNDIMETHYL4NITROBENZENAMINE

NNDIMETHYLPNITROANILINE

P(DIMETHYLAMINO)NITROBENZENE

PNITRODIMETHYLANILINE

PNITRONNDIMETHYLANILINE

ZINC03852228

ZINC3852228

CN(C)C1=CC=C(C=C1)(N+)(=O)(O)

InChI=1SC8H10N2O2c19(2)7358(647)10(11)12h36H12H3


BBL000683
Synonyms: N-[3-(5-sulfanyl-1H-tetrazol-1-yl)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1)n1nnnc1S

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CC(=O)Nc1cccc(c1)n1nnnc1S

N(3(25DIHYDRO5THIOXO1HTETRAZOL1YL)PHENYL)ACETAMIDE

N(3(5MERCAPTO1HTETRAZOL1YL)PHENYL)ACETAMIDE

N(3(5SULFANYL1HTETRAZOL1YL)PHENYL)ACETAMIDE

N(3(5SULFANYLIDENE2HTETRAZOL1YL)PHENYL)ACETAMIDE

N(3(5THIOXO2HTETRAZOL1YL)PHENYL)ACETAMIDE

ZINC5685873

1(3ACETAMIDOPHENYL)1HTETRAZOLE5THIOL

1(3ACETAMIDOPHENYL)5MERCAPTOTETRAZOLE

1(3ACETAMIDOPHENYL)TETRAZOLE5THIOL

1(3ACETAMINOPHENYL)5MERCAPTO1HTETRAZOLE

1(MACETAMIDO)PHENY5MERCAPTOTETRAZOLE

14070485

3(5MERCAPTO1HTETRAZOL1YL)ACETANILIDE

ACETAMIDEN(3(25DIHYDRO5THIOXO1HTETRAZOL1YL)PHENYL)

CC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

InChI=1SC9H9N5OSc16(15)1073248(57)149(16)11121314h25H1H3(H1015)(H111316)


BBL000684
Synonyms: 2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1CC(=NN1c1ccccc1)c1ccccc1

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O=C1CC(=NN1c1ccccc1)c1ccccc1

ZINC18158601

13DIPHENYL2PYRAZOLIN5ONE

13DIPHENYL45DIHYDRO1HPYRAZOL5ONE

13DIPHENYL5(4H)PYRAZOLONE

24DIHYDRO25DIPHENYL3HPYRAZOL3ONE

25DIPHENYL24DIHYDRO3HPYRAZOL3ONE

25DIPHENYL24DIHYDROPYRAZOL3ONE

25DIPHENYL4HPYRAZOL3ONE

2PYRAZOLIN5ONE13DIPHENYL

2PYRAZOLIN5ONE13DIPHENYL(8CI)

2PYRAZOLIN5ONE3DIPHENYL

3HPYRAZOL3ONE24DIHYDRO25DIPHENYL

3HPYRAZOL3ONE4DIHYDRO25DIPHENYL

4845492

5PYRAZOLONE13DIPHENYL

5PYRAZOLONE3DIPHENYL

C1C(=NN(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI=1SC15H12N2Oc18151114(127314812)1617(15)1395261013h110H11H2


BBL000685
Synonyms: N-(4-bromo-2-nitrophenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1[N+](=O)[O-])Br

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CC(=O)Nc1ccc(cc1(N+)(=O)(O))Br

4BROMO2NITROACETANILIDE

881505

ACETAMIDEN(4BROMO2NITROPHENYL)

MFCD00024299

N(4BROMANYL2NITROPHENYL)ETHANAMIDE

N(4BROMO2NITROPHENYL)ACETAMIDE

N1(4BROMO2NITROPHENYL)ACETAMIDE

NACETYL4BROMO2NITROANILINE

ZINC000003852528

ZINC03852528

ZINC3852528

CC(=O)NC1=C(C=C(C=C1)Br)(N+)(=O)(O)

InChI=1SC8H7BrN2O3c15(12)107326(9)48(7)11(13)14h24H1H3(H1012)


BBL000686
Synonyms: 2,7-dinitro-9H-fluorene
Smiles: [O-][N+](=O)c1ccc2c(c1)Cc1c2ccc(c1)[N+](=O)[O-]

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(O)(N+)(=O)c1ccc2c(c1)Cc1c2ccc(c1)(N+)(=O)(O)

27DINITRO9HFLUORENE

27DINITROFLUORENE

5405538

9HFLUORENE27DINITRO

9HFLUORENE27DINITRO(9CI)

9HFLUORENE7DINITRO

FLUORENE27DINITRO

FLUORENE7DINITRO

ZINC01680753

ZINC1680753

C1C2=C(C=CC(=C2)(N+)(=O)(O))C3=C1C=C(C=C3)(N+)(=O)(O)

InChI=1SC13H8N2O4c1614(17)1013128(610)59711(15(18)19)2413(9)12h1467H5H2


BBL000687
Synonyms: 1-ethyl-2-methyl-4-phenyl-1H-pyrrole-3-carboxylicacid
Smiles: CCn1cc(c(c1C)C(=O)O)c1ccccc1

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CCn1cc(c(c1C)C(=O)O)c1ccccc1

MFCD00445989

ZINC000002565493

ZINC2565493

1ETHYL2METHYL4PHENYL1HPYRROLE3CARBOXYLICACID

1ETHYL2METHYL4PHENYLPYRROLE3CARBOXYLICACID

293326224

CCN1C=C(C(=C1C)C(=O)O)C2=CC=CC=C2

InChI=1SC14H15NO2c1315912(117546811)13(10(15)2)14(16)17h49H3H212H3(H1617)


BBL000688
Synonyms: N-acetyltryptophan
Smiles: CC(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2

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CC(=O)NC(C(=O)O)Cc1c(nH)c2c1cccc2

DLACETYLTRYPTOPHAN

DLALPHAACETAMIDOINDOLE3PROPIONICACID

DLALPHAACETYLAMINO3INDOLEPROPIONICACID

DLNACETYLTRYPTOPHAN

DLTRYPTOPHANNACETYL

2(ACETYLAMINO)3(1HINDOL3YL)PROPANOICACID

2(ACETYLAMINO)3INDOL3YLPROPANOICACID

NALPHAACETYLDLTRYPTOPHAN

TRYPTOPHANNACETYL

TRYPTOPHANNACETYLDL

TRYPTOPHANNACETYLL

ZINC000000080812

ZINC000000080814

2ACETAMIDO3(1HINDOL3YL)PROPANOICACID

2ACETAMIDO3(1HINDOL3YL)PROPIONICACID

2ACETYLAMINO3(1HINDOL3YL)PROPIONICACID

87321

ACETYLDLTRYPTOPHAN

ACETYLTRYPTOPHAN

LTRYPTOPHANNACETYL

MFCD00005644

NAACETYLDLTRYPTOPHAN

NACETYLDLTRYPTOPHAN

NACETYLDLTRYPTOPHANE

NACETYLDLTRYPTOPHEN

NACETYLTRPOH

NACETYLTRYPTOPHAN

NACETYLTRYPTOPHANATESODIUM

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O

InChI=1SC13H14N2O3c18(16)1512(13(17)18)6971411532410(9)11h2571214H6H21H3(H1516)(H1718)


BBL000689
Synonyms: 4-(2-chloroethyl)benzenesulfonamide
Smiles: ClCCc1ccc(cc1)S(=O)(=O)N

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ClCCc1ccc(cc1)S(=O)(=O)N

ZINC00039700

ZINC39700

4(2CHLOROETHYL)BENZENE1SULFONAMIDE

4(2CHLOROETHYL)BENZENESULFONAMIDE

4(2CHLOROETHYL)BENZENESULPHONAMIDE

5378858

C1=CC(=CC=C1CCCl)S(=O)(=O)N

InChI=1SC8H10ClNO2Sc9657138(427)13(1011)12h14H56H2(H2101112)


BBL000690
Synonyms: 1-(5-amino-2,3-dihydro-1H-indol-1-yl)ethanone
Smiles: Nc1ccc2c(c1)CCN2C(=O)C

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Nc1ccc2c(c1)CCN2C(=O)C

ZINC00080838

ZINC80838

ETHANONE1(5AMINO23DIHYDRO1HINDOL1YL)

1(5AMINO23DIHYDRO1HINDOL1YL)ETHAN1ONE

1(5AMINO23DIHYDRO1HINDOL1YL)ETHANONE

1(5AMINO23DIHYDROINDOL1YL)ETHANONE

1(5AMINOINDOLIN1YL)ETHANONE

1ACETYL23DIHYDRO1HINDOL5AMINE

1ACETYL23DIHYDRO1HINDOL5YLAMINE

1ACETYL5AMINO23DIHYDRO(1H)INDOLE

1ACETYL5AMINO23DIHYDRO1HINDOLE

1ACETYL5AMINO23DIHYDROINDOLE

1ACETYL5AMINOINDOLINE

1ACETYL5INDOLINAMINE

1ACETYLINDOLIN5AMINE

4993968

CC(=O)N1CCC2=C1C=CC(=C2)N

InChI=1SC10H12N2Oc17(13)1254869(11)2310(8)12h236H4511H21H3


BBL000691
Synonyms: ethylN~2~-(phenylcarbonyl)argininate
Smiles: CCOC(=O)C(NC(=O)c1ccccc1)CCCNC(=N)N

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CCOC(=O)C(NC(=O)c1ccccc1)CCCNC(=N)N

ethylN~2~(phenylcarbonyl)argininate

ETHYLN2(PHENYLCARBONYL)ARGININATE

ETHYLN2BENZOYLN5(DIAMINOMETHYLIDENE)LORNITHINATE

ETHYL2BENZAMIDO5(DIAMINOMETHYLIDENEAMINO)PENTANOATE

ETHYL5((AMINO(IMINO)METHYL)AMINO)2(BENZOYLAMINO)PENTANOATE

ETHYL5CARBAMIMIDAMIDO2(PHENYLFORMAMIDO)PENTANOATE

128805947

2(BENZOYLAMINO)5GUANIDINOPENTANOICACIDETHYLESTER

MFCD03407280

ZINC000001529252

ZINC000001540610

CCOC(=O)C(CCCN=C(N)N)NC(=O)C1=CC=CC=C1

InChI=1SC15H22N4O3c122214(21)12(96101815(16)17)1913(20)117435811h357812H26910H21H3(H1920)(H4161718)


BBL000692
Synonyms: 5-methyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: CSc1nn2c(n1)nc(cc2O)C

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CSc1nn2c(n1)nc(cc2O)C

5methyl2(methylsulfanyl)(124)triazolo(15a)pyrimidin7ol

40775788


BBL000693
Synonyms: 2-hydroxy-3,5-dinitrobenzoicacid
Smiles: [O-][N+](=O)c1cc(C(=O)O)c(c(c1)[N+](=O)[O-])O

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(O)(N+)(=O)c1cc(C(=O)O)c(c(c1)(N+)(=O)(O))O

2HYDROXY35DINITROBENZENECARBOXYLATE

2HYDROXY35DINITROBENZOICACID

35DINITRO2HYDROXYBENZOICACID

35DINITRO2SALICYLICACID

35DINITROSALICYLATE

35DINITROSALICYLICACID

35DINITROSALICYLICACID(LEADSALT)(DRY)

35DINITROSALICYLICACID(LEADSALT)(DRY)(FORBIDDEN)

35DINITROSALICYLICACIDSOLUTION

609994

BENZOICACID2HYDROXY35DINITRO

BENZOICACID35DINITRO2HYDROXY

MFCD00007104

ODINITROCARBOXYLPHENOL

SALICYLICACID35DINITRO

SALICYLICACID5DINITRO

ZINC000034772749

ZINC34772749

C1=C(C=C(C(=C1(N+)(=O)(O))O)C(=O)O)(N+)(=O)(O)

InChI=1SC7H4N2O7c1064(7(11)12)13(8(13)14)25(6)9(15)16h1210H(H1112)


BBL000694
Synonyms: 1-(1H-indol-3-yl)butan-1-one
Smiles: CCCC(=O)c1c[nH]c2c1cccc2

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CCCC(=O)c1c(nH)c2c1cccc2

1(1Hindol3yl)butan1one

1BUTANONE1(1HINDOL3YL)

1INDOL3YLBUTAN1ONE

22582678

1(1HINDOL3YL)1BUTANONE

1(1HINDOL3YL)1BUTANONE95

MFCD00086142

ZINC000000191083

ZINC00191083

ZINC191083

CCCC(=O)C1=CNC2=CC=CC=C21

InChI=1SC12H13NOc12512(14)108131174369(10)11h346813H25H21H3


BBL000695
Synonyms: ethylphenylcarbamate
Smiles: CCOC(=O)Nc1ccccc1

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CCOC(=O)Nc1ccccc1

ETHANOLCARBANILATE

ETHANOLCARBANILATE(7CI)

ETHOXYNBENZAMIDE

ETHYLCARBANILATE

ETHYLESTERKYSELINYKARBANILOVE

ETHYLESTEROFPHENYLCARBAMICACID

ETHYLNPHENYLCARBAMATE

ETHYLNPHENYLCARBANILATE

ETHYLNPHENYLURETHAN

ETHYLNPHENYLURETHANE

ETHYLPHENYLCARBAMATE

101995

PHENYLURETHAN

PHENYLURETHAN(E)

PHENYLURETHANE

URETHANEPHENYL

URETHANPHENYL

ZINC12416739

CARBAMICACIDNPHENYLETHYLESTER

CARBAMICACIDPHENYLETHYLESTER

CARBANILICACIDETHYLESTER

N(ETHOXYCARBONYL)ANILINE

NPHENYLCARBAMICACIDETHYLESTER

NPHENYLETHYLCARBAMATE

NPHENYLURETHANE

PHENYLCARBAMICACIDETHYL

PHENYLCARBAMICACIDETHYLESTER

PHENYLETHYLCARBAMATE

CCOC(=O)NC1=CC=CC=C1

InChI=1SC9H11NO2c12129(11)108643578h37H2H21H3(H1011)


BBL000696
Synonyms: (5Z)-5-[4-(dimethylamino)benzylidene]-2-thioxo-1,3-thiazinan-4-one
Smiles: CN(c1ccc(cc1)/C=C/1\CSC(=S)NC1=O)C

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CN(c1ccc(cc1)C=C1CSC(=S)NC1=O)C

(5Z)5((4DIMETHYLAMINOPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZINAN4ONE

(5Z)5(4(DIMETHYLAMINO)BENZYLIDENE)2THIOXO13THIAZINAN4ONE

1160484923

5((4(DIMETHYLAMINO)PHENYL)METHYLENE)2THIOXO13THIAZAPERHYDROIN4ONE

MFCD01873810

ZINC000000121629

ZINC00121629

ZINC121629

(5Z)5((4(dimethylamino)phenyl)methylidene)2sulfanylidene13thiazinan4one

CN(C)C1=CC=C(C=C1)C=C2CSC(=S)NC2=O

InChI=1SC13H14N2OS2c115(2)11539(4611)71081813(17)1412(10)16h37H8H212H3(H141617)b107+


BBL000697
Synonyms: 6-hydroxy-4,8-dioxo-1,3,2lambda~2~-dioxaplumbocane-6-carboxylicacid
Smiles: O=C1O[Pb]OC(=O)CC(C1)(O)C(=O)O

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O=C1O(Pb)OC(=O)CC(C1)(O)C(=O)O

6hydroxy48dioxo132lambda~2~dioxaplumbocane6carboxylicacid

6HYDROXY48DIOXO132LAMBDA2DIOXAPLUMBOCANE6CARBOXYLICACID

14450603

6HYDROXY48DIOXO132DIOXAPLUMBOCANE6CARBOXYLICACID

MFCD01825262

3carboxy3hydroxypentanedioatelead(2+)

C(C(=O)(O))C(CC(=O)(O))(C(=O)O)O(Pb+2)

InChI=1SC6H8O7Pbc73(8)16(135(11)12)24(9)10h13H12H2(H78)(H910)(H1112)q+2p2


BBL000698
Synonyms: 2-hydroxybenzoate
Smiles: [O-]C(=O)c1ccccc1O

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(O)C(=O)c1ccccc1O

2CARBOXYBENZENOLATE

2HYDROXYBENZOATE

2HYDROXYBENZOICACIDANION

2HYDROXYBENZOICACIDION(1)

2HYDROXYPHENYLFORMATE

2OXYLATOBENZOATE

54217

BENZOICACID2HYDROXYION(1)

MFCD00984876

OHYDROBENZOATE

OHYDROBENZOICACID

OHYDROXYBENZOATE

OHYDROXYBENZOATEANION

POLYSALICYLATE

SALICYLATE

SALICYLATEANION

SALICYLATEION

SALICYLICACIDION(1)

ZINC000000001554

ZINC00001554

2carboxyphenolate

C1=CC=C(C(=C1)C(=O)O)(O)

InChI=1SC7H6O3c8642135(6)7(9)10h148H(H910)p1


BBL000699
Synonyms: 7-hydroxynaphthalene-1,3-disulfonate
Smiles: Oc1ccc2c(c1)c(cc(c2)S(=O)(=O)[O-])S(=O)(=O)[O-]

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Oc1ccc2c(c1)c(cc(c2)S(=O)(=O)(O))S(=O)(=O)(O)

ZINC000001577151

ZINC01577151

2HYDROXYNAPHTHALENE68DISULFONATE

7HYDROXYNAPHTHALENE13DISULFONATE

7OXIDANYLNAPHTHALENE13DISULFONATE

842182

MFCD01026123

6oxido4sulfonaphthalene2sulfonate

C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)(O))S(=O)(=O)O)(O)

InChI=1SC10H8O7S2c11721638(18(1213)14)510(9(6)47)19(1516)17h1511H(H121314)(H151617)p2


BBL000700
Synonyms: 4-O-alpha-D-glucopyranosyl-L-glucopyranose
Smiles: OC[C@@H]1OC(O)[C@H]([C@@H]([C@H]1O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)O)O

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OC(C@@H)1OC(O)(C@H)((C@@H)((C@H)1O(C@H)1O(C@H)(CO)(C@H)((C@@H)((C@H)1O)O)O)O)O

ZINC000005222455

ZINC000005222464

4OALPHADGLUCOPYRANOSYLLGLUCOPYRANOSE

MFCD18804057

(2R3S4S5R6R)2(hydroxymethyl)6((2S3R4S5S)456trihydroxy2(hydroxymethyl)oxan3yl)oxyoxane345triol

C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O

InChI=1SC12H22O11c13135(15)6(16)9(19)12(223)23104(214)2111(20)8(18)7(10)17h320H12H2t34+56+7+8+910+11?12m1s1


BBL000701
Synonyms: N'-acetyl-N-phenylbenzohydrazide
Smiles: CC(=O)NN(C(=O)c1ccccc1)c1ccccc1

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CC(=O)NN(C(=O)c1ccccc1)c1ccccc1

70609119

N(DIPHENYLCARBONYLAMINO)ACETAMIDE

NACETYLNPHENYLBENZOHYDRAZIDE

NBENZOYLNPHENYLACETOHYDRAZIDE

ZINC00121565

ZINC121565

CC(=O)NN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2

InChI=1SC15H14N2O2c112(18)1617(14106371114)15(19)138425913h211H1H3(H1618)


BBL000702
Synonyms: 3-({(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)propan-1-ol
Smiles: OCCC/N=C/c1cccn1c1ccc(cc1)[N+](=O)[O-]

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OCCCN=Cc1cccn1c1ccc(cc1)(N+)(=O)(O)

3(((E)(1(4nitrophenyl)1Hpyrrol2yl)methylidene)amino)propan1ol

333774257

MFCD00422465

ZINC000003155688


BBL000703
Synonyms: 3,3-dibromo-2,3,8,9,10,11-hexahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepine-4,13(1H,7H)-dione
Smiles: O=c1n2CCCCCc2nc2c1c1CCC(C(=O)c1s2)(Br)Br

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O=c1n2CCCCCc2nc2c1c1CCC(C(=O)c1s2)(Br)Br

33dibromo23891011hexahydro(1)benzothieno(2345)pyrimido(12a)azepine413(1H7H)dione

77DIBROMO23PENTAMETHYLENE56DIHYDRO(1)BENZOTHIENO(23D)PYRIMIDINE48(3H7H)DIONE

ZINC000000728253

ZINC00728253

ZINC728253

299962371

MFCD00406493

C1CCC2=NC3=C(C4=C(S3)C(=O)C(CC4)(Br)Br)C(=O)N2CC1

InChI=1SC15H14Br2N2O2Sc1615(17)6581013(2211(8)12(15)20)1894213719(9)14(10)21h17H2


BBL000704
Synonyms: ethyl7-oxo-2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCC2=O

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCC2=O

ethyl7oxo2((phenylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate

ETHYL2BENZAMIDO7OXO56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE

96334439

MFCD00387236

ZINC000000083565

ZINC00083565

ZINC83565

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)C3=CC=CC=C3

InChI=1SC18H17NO4Sc122318(22)1412961013(20)15(12)2417(14)1916(21)117435811h3578H26910H21H3(H1921)


BBL000705
Synonyms: N-methyl-N-{(1Z)-1-[methyl(phenyl)amino]ethylidene}anilinium
Smiles: C/C(=[N+](/c1ccccc1)\C)/N(c1ccccc1)C

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CC(=(N+)(c1ccccc1)C)N(c1ccccc1)C

NMETHYLN((1Z)1(METHYL(PHENYL)AMINO)ETHYLIDENE)ANILINIUM

ZINC18193586

methyl(1(Nmethylanilino)ethylidene)phenylazanium

CC(=(N+)(C)C1=CC=CC=C1)N(C)C2=CC=CC=C2

InChI=1SC16H19N2c114(17(2)15106471115)18(3)16128591316h413H13H3q+1


BBL000706
Synonyms: ethyl5-methyl-4-phenyl-2-[(phenylcarbonyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc(c1c1ccccc1)C

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc(c1c1ccccc1)C

ETHYL2BENZAMIDO5METHYL4PHENYLTHIOPHENE3CARBOXYLATE

ETHYL5METHYL4PHENYL2((PHENYLCARBONYL)AMINO)THIOPHENE3CARBOXYLATE

MFCD00550064

ZINC000000850549

ZINC00850549

ZINC850549

2BENZOYLAMINO5METHYL4PHENYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

43088502

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=CC=CC=C3

InChI=1SC21H19NO3Sc132521(24)1817(15106471115)14(2)2620(18)2219(23)16128591316h413H3H212H3(H2223)


BBL000707
Synonyms: 2,3,8,9-tetrahydro[1]benzothieno[2,3-d]pyrrolo[1,2-a]pyrimidine-6,10(1H,7H)-dione
Smiles: O=C1CCCc2c1sc1c2c(=O)n2c(n1)CCC2

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O=C1CCCc2c1sc1c2c(=O)n2c(n1)CCC2

2389tetrahydro(1)benzothieno(23d)pyrrolo(12a)pyrimidine610(1H7H)dione

ZINC00272986

ZINC272986

141581819

C1CC2=C(C(=O)C1)SC3=C2C(=O)N4CCCC4=N3

InChI=1SC13H12N2O2Sc16841371012(1811(7)8)14952615(9)13(10)17h16H2


BBL000708
Synonyms: 2-(2-hydroxy-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Smiles: Oc1cc(ccc1N1C(=O)c2c(C1=O)cccc2)[N+](=O)[O-]

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Oc1cc(ccc1N1C(=O)c2c(C1=O)cccc2)(N+)(=O)(O)

ZINC000005517286

ZINC05517286

ZINC5517286

117346073

2(2HYDROXY4NITROPHENYL)1HISOINDOLE13(2H)DIONE

2(2HYDROXY4NITROPHENYL)ISOINDOLE13DIONE

MFCD00270772

N(2HYDROXY4NITROPHENYL)PHTHALIMIDE

N(4NITRO2HYDROXYPHENYL)PHTHALIMIDE

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=C(C=C(C=C3)(N+)(=O)(O))O

InChI=1SC14H8N2O5c171278(16(20)21)5611(12)1513(18)9312410(9)14(15)19h1717H


BBL000709
Synonyms: ethyl2-(acetylamino)-6-bromo-7-hydroxy-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2O)Br

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CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2O)Br

ETHYL2(ACETYLAMINO)6BROMO7HYDROXY1BENZOTHIOPHENE3CARBOXYLATE

ETHYL2ACETAMIDO6BROMO7HYDROXY1BENZOTHIOPHENE3CARBOXYLATE

MFCD00426585

ZINC000000850534

ZINC00850534

ZINC850534

113407935

2ACETYLAMINO6BROMO7HYDROXYBENZO(B)THIOPHENE3CARBOXYLICACIDETHYLESTER

CCOC(=O)C1=C(SC2=C1C=CC(=C2O)Br)NC(=O)C

InChI=1SC13H12BrNO4Sc131913(18)97458(14)10(17)11(7)2012(9)156(2)16h4517H3H212H3(H1516)


BBL000710
Synonyms: ethyl(4Z)-4-(hydroxyimino)-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)/C(=N\O)/CCC2

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CCOC(=O)c1oc2c(c1C)C(=NO)CCC2

ethyl(4Z)4(hydroxyimino)3methyl4567tetrahydro1benzofuran2carboxylate

ETHYL(4Z)4HYDROXYIMINO3METHYL67DIHYDRO5H1BENZOFURAN2CARBOXYLATE

296266698

MFCD01534537

ZINC000100207884

ZINC13114925

CCOC(=O)C1=C(C2=C(O1)CCCC2=NO)C

InChI=1SC12H15NO4c131612(14)117(2)108(1315)5469(10)1711h15H36H212H3b138


BBL000711
Synonyms: ethyl(7Z)-2-(acetylamino)-7-(hydroxyimino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC/C/2=N/O

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CCOC(=O)c1c(NC(=O)C)sc2c1CCCC2=NO

ethyl(7Z)2(acetylamino)7(hydroxyimino)4567tetrahydro1benzothiophene3carboxylate

MFCD00550028

ZINC000013941926

108940074


BBL000712
Synonyms: ethyl5-methoxy-2-methyl-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC)cc2

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CCOC(=O)c1c(C)oc2c1cc(OC)cc2

ETHYL5METHOXY2METHYL1BENZOFURAN3CARBOXYLATE

ETHYL5METHOXY2METHYLBENZO(B)FURAN3CARBOXYLATE

ETHYL5METHOXY2METHYLBENZOFURAN3CARBOXYLATE

MFCD00435501

ZINC000000281936

ZINC00281936

ZINC281936

5METHOXY2METHYLBENZOFURAN3CARBOXYLICACIDETHYLESTER

7287516

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)C

InChI=1SC13H14O4c141613(14)128(2)1711659(153)710(11)12h57H4H213H3


BBL000713
Synonyms: 2-amino-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccccc1)C(=O)CC(C2)(C)C

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N#CC1=C(N)OC2=C(C1c1ccccc1)C(=O)CC(C2)(C)C

2amino77dimethyl5oxo4phenyl5678tetrahydro4Hchromene3carbonitrile

107752976

2AMINO3CYANO4PHENYL77DIMETHYL78DIHYDRO4H1BENZOPYRAN5(6H)ONE

2AMINO77DIMETHYL5OXO4PHENYL4H678TRIHYDROCHROMENE3CARBONITRILE

2amino77dimethyl5oxo4phenyl68dihydro4Hchromene3carbonitrile

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3)C(=O)C1)C

InChI=1SC18H18N2O2c118(2)813(21)1614(918)2217(20)12(1019)15(16)116435711h3715H8920H212H3


BBL000714
Synonyms: 4-(methylamino)phenolate
Smiles: CNc1ccc(cc1)[O-]

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CNc1ccc(cc1)(O)

4(METHYLAMINO)PHENOLATE

CNC1=CC=C(C=C1)(O)

InChI=1SC7H9NOc186247(9)536h2589H1H3p1


BBL000715
Synonyms: 4-aminonaphthalene-1-sulfonate
Smiles: Nc1ccc(c2c1cccc2)S(=O)(=O)[O-]

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Nc1ccc(c2c1cccc2)S(=O)(=O)(O)

ZINC000001555329

ZINC01555329

130132

4AMINO1NAPHTHALENESULFONATE

4AMINONAPHTHALENE1SULFONATE

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)(O))N

InChI=1SC10H9NO3Sc1195610(15(1213)14)842137(8)9h16H11H2(H121314)p1


BBL000716
Synonyms: 1-(tert-butylamino)-3-phenoxypropan-2-ol
Smiles: OC(COc1ccccc1)CNC(C)(C)C

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OC(COc1ccccc1)CNC(C)(C)C

ZINC000000213022

ZINC000000213026

MFCD00458481

1(TERTBUTYLAMINO)3PHENOXY2PROPANOL

1(TERTBUTYLAMINO)3PHENOXYPROPAN2OL

1TERTBUTYLAMINO3PHENOXYPROPAN2OL

3((TERTBUTYL)AMINO)1PHENOXYPROPAN2OL

64980401

CC(C)(C)NCC(COC1=CC=CC=C1)O

InChI=1SC13H21NO2c113(23)14911(15)1016127546812h48111415H910H213H3


BBL000717
Synonyms: 2,3,8,9,10,11-hexahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepine-4,13(1H,7H)-dione
Smiles: O=C1CCCc2c1sc1c2c(=O)n2c(n1)CCCCC2

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O=C1CCCc2c1sc1c2c(=O)n2c(n1)CCCCC2

23891011hexahydro(1)benzothieno(2345)pyrimido(12a)azepine413(1H7H)dione

ZINC00126497

ZINC126497

141581808

C1CCC2=NC3=C(C4=C(S3)C(=O)CCC4)C(=O)N2CC1

InChI=1SC15H16N2O2Sc181064591214(2013(9)10)16117213817(11)15(12)19h18H2


BBL000718
Synonyms: N-[3-(hydrazinylcarbonyl)-4,5-dimethylthiophen-2-yl]benzamide
Smiles: NNC(=O)c1c(NC(=O)c2ccccc2)sc(c1C)C

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NNC(=O)c1c(NC(=O)c2ccccc2)sc(c1C)C

THIOPHENE3CARBOHYDRAZIDE2BENZOYLAMINO45DIMETHYL

ZINC000003141348

ZINC03141348

ZINC3141348

MFCD00298465

N(3(HYDRAZINECARBONYL)45DIMETHYLTHIOPHEN2YL)BENZAMIDE

N(3(HYDRAZINOCARBONYL)45DIMETHYL2THIENYL)BENZAMIDE

N(3(HYDRAZINYLCARBONYL)45DIMETHYLTHIOPHEN2YL)BENZAMIDE

N(345DIMETHYL(2THIENYL))BENZAMIDE

N(3HYDRAZINOCARBONYL45DIMETHYLTHIOPHEN2YL)BENZAMIDE

73696410

CC1=C(SC(=C1C(=O)NN)NC(=O)C2=CC=CC=C2)C

InChI=1SC14H15N3O2Sc189(2)2014(11(8)13(19)1715)1612(18)106435710h37H15H212H3(H1618)(H1719)


BBL000719
Synonyms: 4,5-dimethyl-2-[(phenylcarbonyl)amino]thiophene-3-carboxylicacid
Smiles: O=C(c1ccccc1)Nc1sc(c(c1C(=O)O)C)C

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O=C(c1ccccc1)Nc1sc(c(c1C(=O)O)C)C

ZINC000000097789

ZINC97789

MFCD00437066

2(BENZOYLAMINO)45DIMETHYL3THIOPHENECARBOXYLICACID

2(BENZOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLICACID

2BENZAMIDO45DIMETHYLTHIOPHENE3CARBOXYLICACID

2BENZOYLAMINO45DIMETHYLTHIOPHENE3CARBOXYLICACID

45DIMETHYL2((PHENYLCARBONYL)AMINO)THIOPHENE3CARBOXYLICACID

52535725

CC1=C(SC(=C1C(=O)O)NC(=O)C2=CC=CC=C2)C

InChI=1SC14H13NO3Sc189(2)1913(11(8)14(17)18)1512(16)106435710h37H12H3(H1516)(H1718)


BBL000720
Synonyms: ethyl2-(acetylamino)-7-hydroxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCCC2O

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CCOC(=O)c1c(NC(=O)C)sc2c1CCCC2O

ethyl2(acetylamino)7hydroxy4567tetrahydro1benzothiophene3carboxylate

128811994

MFCD00550027

ZINC000000195169

ZINC000000195171

ethyl2acetamido7hydroxy4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2O)NC(=O)C

InChI=1SC13H17NO4Sc131813(17)1085469(16)11(8)1912(10)147(2)15h916H36H212H3(H1415)


BBL000721
Synonyms: ethyl2-[(3-bromopropanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: BrCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2

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BrCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2

ethyl2((3bromopropanoyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD00427048

ZINC000003156648

ZINC03156648

ZINC3156648

299962553

ethyl2(3bromopropanoylamino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCBr

InChI=1SC14H18BrNO3Sc121914(18)129534610(9)2013(12)1611(17)7815h28H21H3(H1617)


BBL000722
Synonyms: ethyl(4Z)-4-[(acetyloxy)imino]-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)/C(=N\OC(=O)C)/CCC2

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CCOC(=O)c1oc2c(c1C)C(=NOC(=O)C)CCC2

ethyl(4Z)4((acetyloxy)imino)3methyl4567tetrahydro1benzofuran2carboxylate

ETHYL(4Z)4ACETYLOXYIMINO3METHYL67DIHYDRO5H1BENZOFURAN2CARBOXYLATE

MFCD09222981

ZINC000033294459

ZINC04471960

ZINC4471960

296266687

CCOC(=O)C1=C(C2=C(O1)CCCC2=NOC(=O)C)C

InChI=1SC14H17NO5c141814(17)138(2)1210(15209(3)16)65711(12)1913h47H213H3b1510


BBL000723
Synonyms: 2-phenyl-5,6,7,8-tetrahydro-4H-[1]benzothieno[2,3-d][1,3]oxazin-4-one
Smiles: O=c1oc(nc2c1c1CCCCc1s2)c1ccccc1

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O=c1oc(nc2c1c1CCCCc1s2)c1ccccc1

2phenyl5678tetrahydro4H(1)benzothieno(23d)(13)oxazin4one

73696352

ZINC000000068444

ZINC00068444

ZINC68444

MFCD00424228

2phenyl5678tetrahydro(1)benzothiolo(23d)(13)oxazin4one

C1CCC2=C(C1)C3=C(S2)N=C(OC3=O)C4=CC=CC=C4

InChI=1SC16H13NO2Sc18161311845912(11)2015(13)1714(1916)106213710h1367H4589H2


BBL000724
Synonyms: ethyl(7Z)-2-(acetylamino)-7-[(acetyloxy)imino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC/C/2=N/OC(=O)C

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CCOC(=O)c1c(NC(=O)C)sc2c1CCCC2=NOC(=O)C

ethyl(7Z)2(acetylamino)7((acetyloxy)imino)4567tetrahydro1benzothiophene3carboxylate

MFCD00550050

ZINC000013941934

299962564


BBL000725
Synonyms: N-(3-formyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide
Smiles: O=Cc1c(NC(=O)c2ccccc2)sc2c1CCCC2

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O=Cc1c(NC(=O)c2ccccc2)sc2c1CCCC2

N(3formyl4567tetrahydro1benzothiophen2yl)benzamide

MFCD00426591

51948040

ZINC000000359464

ZINC00359464

ZINC359464

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C=O

InChI=1SC16H15NO2Sc18101312845914(12)2016(13)1715(19)116213711h136710H4589H2(H1719)


BBL000726
Synonyms: ethyl4-[(5-bromo-2-hydroxybenzyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NCc1cc(Br)ccc1O

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CCOC(=O)c1ccc(cc1)NCc1cc(Br)ccc1O

ETHYL4(((5BROMO2HYDROXYPHENYL)METHYL)AMINO)BENZOATE

ETHYL4((5BROMO2HYDROXYBENZYL)AMINO)BENZOATE

ETHYL4((5BROMO2HYDROXYPHENYL)METHYLAMINO)BENZOATE

MFCD00416966

ZINC000000847307

ZINC00847307

ZINC847307

4(5BROMO2HYDROXYBENZYLAMINO)BENZOICACIDETHYLESTER

64260895

CCOC(=O)C1=CC=C(C=C1)NCC2=C(C=CC(=C2)Br)O

InChI=1SC16H16BrNO3c122116(20)113614(7411)181012913(17)5815(12)19h391819H210H21H3


BBL000727
Synonyms: ethyl4,5-dimethyl-2-[(phenylcarbonyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc(c1C)C

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc(c1C)C

ETHYL2(BENZOYLAMINO)45DIMETHYL3THIOPHENECARBOXYLATE

ETHYL2(BENZOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE

ETHYL2BENZAMIDO45DIMETHYL3THIOPHENECARBOXYLATE

ETHYL2BENZAMIDO45DIMETHYLTHIOPHENE3CARBOXYLATE

ETHYL45DIMETHYL2((PHENYLCARBONYL)AMINO)THIOPHENE3CARBOXYLATE

MFCD00416488

THIOPHENE3CARBOXYLICACID2BENZOYLAMINO45DIMETHYLETHYLESTER

ZINC000000360193

ZINC00360193

ZINC360193

2BENZOYLAMINO45DIMETHYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

52535689

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC=CC=C2

InChI=1SC16H17NO3Sc142016(19)1310(2)11(3)2115(13)1714(18)128657912h59H4H213H3(H1718)


BBL000728
Synonyms: 4-{[3-(ethoxycarbonyl)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoicacid
Smiles: CCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCCC2=O

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CCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCCC2=O

4((3(ethoxycarbonyl)7oxo4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid

4((3ETHOXYCARBONYL7OXO56DIHYDRO4H1BENZOTHIOPHEN2YL)AMINO)4OXOBUTANOICACID

MFCD00397379

ZINC000003683331

ZINC3683331

331760613

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)CCC(=O)O

InChI=1SC15H17NO6Sc122215(21)1284359(17)13(8)2314(12)1610(18)6711(19)20h27H21H3(H1618)(H1920)


BBL000729
Synonyms: ethyl4,5-dimethyl-2-{[(4-methylphenyl)sulfonyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc(c1C)C)NS(=O)(=O)c1ccc(cc1)C

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CCOC(=O)c1c(sc(c1C)C)NS(=O)(=O)c1ccc(cc1)C

ETHYL45DIMETHYL2(((4METHYLPHENYL)SULFONYL)AMINO)3THIOPHENECARBOXYLATE

ETHYL45DIMETHYL2(((4METHYLPHENYL)SULFONYL)AMINO)THIOPHENE3CARBOXYLATE

ETHYL45DIMETHYL2((4METHYLPHENYL)SULFONYLAMINO)THIOPHENE3CARBOXYLATE

ETHYL45DIMETHYL2(PTOLYLSULFONYLAMINO)THIOPHENE3CARBOXYLATE

53976128

MFCD00392201

ZINC000017903282

ZINC17903282

CCOC(=O)C1=C(SC(=C1C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI=1SC16H19NO4S2c152116(18)1411(3)12(4)2215(14)1723(1920)138610(2)7913h6917H5H214H3


BBL000730
Synonyms: ethyl5-acetyl-4-phenyl-2-[(phenylcarbonyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc(c1c1ccccc1)C(=O)C

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc(c1c1ccccc1)C(=O)C

ETHYL5ACETYL2(BENZOYLAMINO)4PHENYL3THIOPHENECARBOXYLATE

ETHYL5ACETYL2BENZAMIDO4PHENYLTHIOPHENE3CARBOXYLATE

ETHYL5ACETYL4PHENYL2((PHENYLCARBONYL)AMINO)THIOPHENE3CARBOXYLATE

MFCD00356090

ZINC000000855394

ZINC00855394

ZINC855394

331760759

5ACETYL2BENZOYLAMINO4PHENYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C(=O)C)NC(=O)C3=CC=CC=C3

InChI=1SC22H19NO4Sc132722(26)1817(15106471115)19(14(2)24)2821(18)2320(25)16128591316h413H3H212H3(H2325)


BBL000731
Synonyms: 3,6-dichloro-4,5-dihydroxynaphthalene-2,7-disulfonate
Smiles: Clc1c(O)c2c(cc1S(=O)(=O)[O-])cc(c(c2O)Cl)S(=O)(=O)[O-]

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Clc1c(O)c2c(cc1S(=O)(=O)(O))cc(c(c2O)Cl)S(=O)(=O)(O)

36DICHLORO45DIHYDROXYNAPHTHALENE27DISULFONATE

77214665

MFCD01823767

ZINC000004499555

ZINC04499555

C1=C2C=C(C(=C(C2=C(C(=C1S(=O)(=O)(O))Cl)O)O)Cl)S(=O)(=O)(O)

InChI=1SC10H6Cl2O8S2c1174(21(1516)17)1325(22(1819)20)8(12)10(14)6(3)9(7)13h121314H(H151617)(H181920)p2


BBL000732
Synonyms: 1,1'-diacetylferrocene
Smiles: CC(=O)C1=CC=CC1[Fe]C1C=CC=C1C(=O)C

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CC(=O)C1=CC=CC1(Fe)C1C=CC=C1C(=O)C

11diacetylferrocene

1273945

MFCD00001424

1cyclopentylethanoneiron

CC(=O)(C)1(CH)(CH)(CH)(CH)1CC(=O)(C)1(CH)(CH)(CH)(CH)1(Fe)

InChI=1S2C7H7OFec2*16(8)742357h2*25H1H3


BBL000733
Synonyms: (5-acetyl-2-nitrothiophen-3-yl)acetonitrile
Smiles: N#CCc1cc(sc1[N+](=O)[O-])C(=O)C

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N#CCc1cc(sc1(N+)(=O)(O))C(=O)C

ZINC000000195152

ZINC00195152

ZINC195152

(5ACETYL2NITROTHIOPHEN3YL)ACETONITRILE

2(5ACETYL2NITRO3THIENYL)ETHANENITRILE

2(5ACETYL2NITROTHIOPHEN3YL)ACETONITRILE

389138345

MFCD01992764

CC(=O)C1=CC(=C(S1)(N+)(=O)(O))CC#N

InChI=1SC8H6N2O3Sc15(11)746(239)8(147)10(12)13h4H2H21H3


BBL000734
Synonyms: 3-[4-(2-hydroxyethyl)piperazin-1-yl]propanenitrile
Smiles: OCCN1CCN(CC1)CCC#N

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OCCN1CCN(CC1)CCC#N

ZINC25952669

1(2CYANOETHYL)4(2HYDROXYETHYL)PIPERAZINE

1PIPERAZINEPROPANENITRILE4(2HYDROXYETHYL)

3(4(2HYDROXYETHYL)PIPERAZIN1YL)PROPANENITRILE

3(4(2HYDROXYETHYL)PIPERAZINYL)PROPANENITRILE

C1CN(CCN1CCC#N)CCO

InChI=1SC9H17N3Oc10213114612(7511)8913h13H139H2


BBL000735
Synonyms: 1-(5-ethyl-2-methyl-1-benzofuran-3-yl)ethanonehydrate
Smiles: CCc1ccc2c(c1)c(C(=O)C)c(o2)C.O

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CCc1ccc2c(c1)c(C(=O)C)c(o2)CO

1(5ETHYL2METHYL1BENZOFURAN3YL)ETHANONEHYDRATE


BBL000736
Synonyms: 5,6-dibromo-2-(4-hydroxy-2-methylphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: BrC1C(Br)C2CC1C1C2C(=O)N(C1=O)c1ccc(cc1C)O

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BrC1C(Br)C2CC1C1C2C(=O)N(C1=O)c1ccc(cc1C)O

1217674071

56DIBROMO2(4HYDROXY2METHYLPHENYL)HEXAHYDRO1H47METHANOISOINDOLE13(2H)DIONE

MFCD05098758

ZINC000101052282

ZINC000101215960

ZINC000242701537

CC1=C(C=CC(=C1)O)N2C(=O)C3C4CC(C3C2=O)C(C4Br)Br

InChI=1SC16H15Br2NO3c1647(20)2310(6)1915(21)11859(12(11)16(19)22)14(18)13(8)17h2489111420H5H21H3


BBL000737
Synonyms: 3,5-dimethyltricyclo[3.3.1.1~3,7~]decan-1-amine
Smiles: CC12CC3CC(C1)(C)CC(C2)(C3)N

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CC12CC3CC(C1)(C)CC(C2)(C3)N

35dimethyltricyclo(3311~37~)decan1amine

41100521

ACTMEMANTINE

APOMEMANTINE

MEDMEMANTINE

MEMANTIN

MEMANTINA

MEMANTINE

MEMANTINE(INN)

MEMANTINE(INNBAN)

(35DIMETHYL1ADAMANTYL)AMINE

(35DIMETHYL1ADAMANTYL)AMINEHYDROCHLORIDE

MEMANTINEHYDROCHLORIDETABLETS

MEMANTINUM

MEMANTINUM(INNLATIN)

MEMATINEHYDROCHLORIDE

MFCD02114015

MYLANMEMANTINE

NOVOMEMANTINE

PMSMEMANTINE

RANMEMANTINE

RATIOMEMANTINE

RIVAMEMANTINE

SANDOZMEMANTINE

SANDOZMEMANTINEFCT

ZINC000003812933

ZINC000100003201

13DIMETHYL5ADAMANTANAMINE

13DIMETHYL5AMINOADAMANTANE

1AMINO35DIMETHYLADAMANTAN

1AMINO35DIMETHYLADAMANTANE

35DIMETHYL1ADAMANTANAMINE

35DIMETHYL1ADAMANTYLAMINE

35DIMETHYL1AMINOADAMANTANE

35DIMETHYLADAMANTAN1AMINE

35DIMETHYLADAMANTAN1YLAMINE

35DIMETHYLADAMANTANYLAMINE

CC12CC3CC(C1)(CC(C3)(C2)N)C

InChI=1SC12H21Nc11039411(2610)812(1359)710h9H3813H212H3


BBL000738
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-6-(methoxymethyl)pyrimidin-4(1H)-one
Smiles: COCc1cc(=O)nc([nH]1)Nc1nc2c(o1)cccc2

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COCc1cc(=O)nc((nH)1)Nc1nc2c(o1)cccc2

MFCD03140983

ZINC000018030005

ZINC18030005

2(13BENZOXAZOL2YLAMINO)6(METHOXYMETHYL)1HPYRIMIDIN4ONE

2(13BENZOXAZOL2YLAMINO)6(METHOXYMETHYL)PYRIMIDIN4(1H)ONE

2(13BENZOXAZOL2YLAMINO)6(METHOXYMETHYL)PYRIMIDIN4OL

2(BENZOOXAZOL2YLAMINO)6METHOXYMETHYLPYRIMIDIN4OL

2(BENZOXAZOL2YLAMINO)6(METHOXYMETHYL)PYRIMIDIN4OL

374918077

COCC1=CC(=O)N=C(N1)NC2=NC3=CC=CC=C3O2

InChI=1SC13H12N4O3c11978611(18)1612(148)1713159423510(9)2013h26H7H21H3(H21415161718)


BBL000739
Synonyms: 4-methoxy-2-nitro-N-phenylaniline
Smiles: COc1ccc(c(c1)[N+](=O)[O-])Nc1ccccc1

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COc1ccc(c(c1)(N+)(=O)(O))Nc1ccccc1

4METHOXY2NITRONPHENYLANILINE

5442466

BENZENAMINE4METHOXY2NITRONPHENYL

MFCD09962463

N(2NITRO4METHOXYPHENYL)ANILINE

ZINC000004366487

ZINC04366487

ZINC4366487

COC1=CC(=C(C=C1)NC2=CC=CC=C2)(N+)(=O)(O)

InChI=1SC13H12N2O3c118117812(13(911)15(16)17)14105324610h2914H1H3


BBL000740
Synonyms: N-(2-methyl-1,3-benzothiazol-5-yl)glycinamide
Smiles: NCC(=O)Nc1ccc2c(c1)nc(s2)C

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NCC(=O)Nc1ccc2c(c1)nc(s2)C

ZINC000001510481

ZINC1510481

MFCD00845978

N(2METHYL13BENZOTHIAZOL5YL)GLYCINAMIDE

2AMINON(2METHYL13BENZOTHIAZOL5YL)ACETAMIDE

2AMINON(2METHYLBENZOTHIAZOL5YL)ACETAMIDE

313502873

ACETAMIDE2AMINON(2METHYL5BENZOTHIAZOLYL)

CC1=NC2=C(S1)C=CC(=C2)NC(=O)CN

InChI=1SC10H11N3OSc1612847(1310(14)511)239(8)156h24H511H21H3(H1314)


BBL000741
Synonyms: ethyl12-oxo-1,2,3,4,7,9,10,12-octahydro-8H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-7-carboxylate
Smiles: CCOC(=O)C1CCCn2c1nc1sc3c(c1c2=O)CCCC3

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CCOC(=O)C1CCCn2c1nc1sc3c(c1c2=O)CCCC3

ethyl12oxo1234791012octahydro8H(1)benzothieno(23d)pyrido(12a)pyrimidine7carboxylate

329059690

MFCD00396984

ZINC000000126472

ZINC000000126473

CCOC(=O)C1CCCN2C1=NC3=C(C2=O)C4=C(S3)CCCC4

InChI=1SC17H20N2O3Sc122217(21)117591914(11)181513(16(19)20)10634812(10)2315h11H29H21H3


BBL000742
Synonyms: ethyl(4Z)-4-({[(2-chlorophenyl)carbonyl]oxy}imino)-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)/C(=N\OC(=O)c1ccccc1Cl)/CCC2

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CCOC(=O)c1oc2c(c1C)C(=NOC(=O)c1ccccc1Cl)CCC2

ethyl(4Z)4((((2chlorophenyl)carbonyl)oxy)imino)3methyl4567tetrahydro1benzofuran2carboxylate

ETHYL(4Z)4(2CHLOROBENZOYL)OXYIMINO3METHYL67DIHYDRO5H1BENZOFURAN2CARBOXYLATE

MFCD01942188

ZINC000033332385

ZINC04471983

ZINC4471983

296244490

CCOC(=O)C1=C(C2=C(O1)CCCC2=NOC(=O)C3=CC=CC=C3Cl)C

InChI=1SC19H18ClNO5c132419(23)1711(2)1614(961015(16)2517)212618(22)12745813(12)20h4578H36910H212H3b2114


BBL000743
Synonyms: 2-chloro-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)benzamide
Smiles: N#Cc1c(NC(=O)c2ccccc2Cl)sc2c1CCCCC2

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N#Cc1c(NC(=O)c2ccccc2Cl)sc2c1CCCCC2

2chloroN(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)benzamide

331760577

ZINC000000309850

ZINC00309850

ZINC309850

MFCD01036770

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C3=CC=CC=C3Cl

InChI=1SC17H15ClN2OSc1814854712(14)16(21)201713(1019)116213915(11)2217h4578H1369H2(H2021)


BBL000744
Synonyms: 1,1'-sulfonylbis(4-bromobenzene)
Smiles: Brc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Br

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Brc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Br

MFCD00017836

SULFONEBIS(PBROMOPHENYL)

ZINC000000640754

ZINC00640754

ZINC640754

11SULFONYLBIS(4BROMOBENZENE)

1BROMANYL4(4BROMOPHENYL)SULFONYLBENZENE

1BROMO4((4BROMOBENZENE)SULFONYL)BENZENE

1BROMO4((4BROMOPHENYL)SULFONYL)BENZENE

1BROMO4(4BROMOBENZENESULFONYL)BENZENE

1BROMO4(4BROMOPHENYL)SULFONYLBENZENE

2050488

44DIBROMODIPHENYLSULFONE

44SULFONYLBIS(BROMOBENZENE)

4BROMOPHENYLSULFONE

BENZENE11SULFONYLBIS(4BROMO

BENZENE11SULFONYLBIS(4BROMO(9CI)

BENZENE1SULFONYLBIS(4BROMO

BIS(4BROMOPHENYL)SULFONE

BIS(PBROMOPHENYL)SULFONE

C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Br)Br

InChI=1SC12H8Br2O2Sc1391511(629)17(1516)127310(14)4812h18H


BBL000745
Synonyms: ethyl2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCC2

ethyl2((phenylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD00265063

ZINC000000037527

ZINC00037527

ZINC37527

52580571

ethyl2benzamido4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3

InChI=1SC18H19NO3Sc122218(21)151310671114(13)2317(15)1916(20)128435912h3589H2671011H21H3(H1920)


BBL000746
Synonyms: ethyl2-(acetylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC2

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CCOC(=O)c1c(NC(=O)C)sc2c1CCC2

ETHYL2(ACETYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE

ETHYL2ACETAMIDO4H5H6HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE

ETHYL2ACETAMIDO56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE

MFCD00450852

ZINC000003682093

ZINC03682093

ZINC3682093

65416888

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C

InChI=1SC12H15NO3Sc131612(15)1085469(8)1711(10)137(2)14h36H212H3(H1314)


BBL000747
Synonyms: 2-(5-chloro-2-hydroxyphenyl)-4-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: Clc1ccc(c(c1)N1C(=O)C2C(C1=O)C(C)C=CC2)O

more...



Clc1ccc(c(c1)N1C(=O)C2C(C1=O)C(C)C=CC2)O

2(5CHLORO2HYDROXYPHENYL)4METHYL3A477ATETRAHYDRO1HISOINDOLE13(2H)DIONE

2(5CHLORO2HYDROXYPHENYL)4METHYL3A477ATETRAHYDROISOINDOLE13DIONE

342422086

MFCD01798797

ZINC000003912979

ZINC000101593055

ZINC000239121167

CC1C=CCC2C1C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)O

InChI=1SC15H14ClNO3c183241013(8)15(20)17(14(10)19)1179(16)5612(11)18h2358101318H4H21H3


BBL000748
Synonyms: ethyl2-{[(3-iodophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cccc(c2)I)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)c2cccc(c2)I)sc2c1CCCC2

ethyl2(((3iodophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD00495503

ZINC000000820939

ZINC00820939

ZINC820939

324065409

ethyl2((3iodobenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=CC=C3)I

InChI=1SC18H18INO3Sc122318(22)1513834914(13)2417(15)2016(21)1165712(19)1011h5710H2489H21H3(H2021)


BBL000749
Synonyms: pyridine-2,6-dicarbonitrile
Smiles: N#Cc1cccc(n1)C#N

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N#Cc1cccc(n1)C#N

PYRIDIN26DICARBONITRIL

PYRIDINE26DICARBONITRILE

ZINC00039552

ZINC39552

13ADAMANTANEDIMETHANOLALPHAALPHAALPHAALPHATETRAMETHYL(6CI)

26DICYANOPYRIDINE

26PYRIDINEDICARBONITRILE

2893336

C1=CC(=NC(=C1)C#N)C#N

InChI=1SC7H3N3c8462137(59)106h13H


BBL000750
Synonyms: diethyl3,3'-(disulfanediyldimethanediyl)bis(5-methyl-1H-pyrazole-4-carboxylate)
Smiles: CCOC(=O)c1c(CSSCc2n[nH]c(c2C(=O)OCC)C)n[nH]c1C

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CCOC(=O)c1c(CSSCc2n(nH)c(c2C(=O)OCC)C)n(nH)c1C

DIETHYL33(DISULFANEDIYLDIMETHANEDIYL)BIS(5METHYL1HPYRAZOLE4CARBOXYLATE)

ETHYL3((((4(ETHOXYCARBONYL)5METHYL1HPYRAZOL3YL)METHYL)DISULFANYL)METHYL)5METHYL1HPYRAZOLE4CARBOXYLATE

ETHYL3(((4ETHOXYCARBONYL5METHYL1HPYRAZOL3YL)METHYLDISULFANYL)METHYL)5METHYL1HPYRAZOLE4CARBOXYLATE

MFCD00366409

ZINC000004579494

ZINC04579494

ZINC4579494

296266494

CCOC(=O)C1=C(NN=C1CSSCC2=NNC(=C2C(=O)OCC)C)C

InChI=1SC16H22N4O4S2c152315(21)139(3)171911(13)7252681214(10(4)182012)16(22)2462h58H214H3(H1719)(H1820)


BBL000751
Synonyms: 1-(5-chloro-2-hydroxyphenyl)pyrrolidine-2,5-dione
Smiles: O=C1CCC(=O)N1c1cc(Cl)ccc1O

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O=C1CCC(=O)N1c1cc(Cl)ccc1O

ZINC000013857685

ZINC13857685

MFCD00455523

1(5CHLORO2HYDROXYPHENYL)PYRROLIDINE25DIONE

2(25DIOXO1PYRROLIDINYL)4CHLOROPHENOL

249277712

25PYRROLIDINEDIONE1(5CHLORO2HYDROXYPHENYL)

C1CC(=O)N(C1=O)C2=C(C=CC(=C2)Cl)O

InChI=1SC10H8ClNO3c116128(13)7(56)129(14)3410(12)15h12513H34H2


BBL000752
Synonyms: 4-phenylcyclohexane-1,2-dicarboxylicacid
Smiles: OC(=O)C1CC(CCC1C(=O)O)c1ccccc1

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OC(=O)C1CC(CCC1C(=O)O)c1ccccc1

ZINC000002570078

ZINC000013857453

MFCD07366552

36299646

4PHENYLCYCLOHEXANE12DICARBOXYLICACID

C1CC(C(CC1C2=CC=CC=C2)C(=O)O)C(=O)O

InChI=1SC14H16O4c1513(16)117610(812(11)14(17)18)9421359h151012H68H2(H1516)(H1718)


BBL000753
Synonyms: ethyl3-methyl-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]thieno[2,3-d]pyrimidine-2-carboxylate
Smiles: CCOC(=O)c1sc2c(c1C)c(=O)n1c(n2)CCC1

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CCOC(=O)c1sc2c(c1C)c(=O)n1c(n2)CCC1

ethyl3methyl4oxo4678tetrahydropyrrolo(12a)thieno(23d)pyrimidine2carboxylate

ETHYL3METHYL4OXO5HYDROPYRROLIDINO(12A)THIOPHENO(23D)PYRIMIDINE2CARBOXYLATE

MFCD00437440

ZINC000000126454

ZINC00126454

ZINC126454

329059623

6HPYRROLO(12A)THIENO(23D)PYRIMIDINE2CARBOXYLICACID78DIHYDRO3METHYL4OXOETHYLESTER

CCOC(=O)C1=C(C2=C(S1)N=C3CCCN3C2=O)C

InChI=1SC13H14N2O3Sc131813(17)107(2)911(1910)14854615(8)12(9)16h36H212H3


BBL000754
Synonyms: ethyl2-(formylamino)-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: O=CNc1sc2c(c1C(=O)OCC)CCCC2=O

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O=CNc1sc2c(c1C(=O)OCC)CCCC2=O

ethyl2(formylamino)7oxo4567tetrahydro1benzothiophene3carboxylate

ETHYL2FORMAMIDO7OXO56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE

96334417

ZINC000004866113

ZINC04866113

ZINC4866113

MFCD00451585

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC=O

InChI=1SC12H13NO4Sc121712(16)974358(15)10(7)1811(9)13614h6H25H21H3(H1314)


BBL000755
Synonyms: ethyl7-oxo-2-{[(phenylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2ccccc2)sc2c1CCCC2=O

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CCOC(=O)c1c(NC(=O)CSc2ccccc2)sc2c1CCCC2=O

ethyl7oxo2(((phenylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate

ETHYL7OXO2((2PHENYLSULFANYLACETYL)AMINO)56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE

ETHYL7OXO2(2PHENYLTHIOACETYLAMINO)456TRIHYDROBENZO(B)THIOPHENE3CARBOXYLATE

MFCD00544453

ZINC000000704416

ZINC00704416

ZINC704416

299962519

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)CSC3=CC=CC=C3

InChI=1SC19H19NO4S2c122419(23)1613961014(21)17(13)2618(16)2015(22)1125127435812h3578H26911H21H3(H2022)


BBL000756
Synonyms: ethyl2-{[(2-chlorophenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2Cl)sc2c1CCCCC2

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CCOC(=O)c1c(NC(=O)c2ccccc2Cl)sc2c1CCCCC2

ethyl2(((2chlorophenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

MFCD00782619

ZINC000001081673

ZINC01081673

ZINC1081673

312949432

ethyl2((2chlorobenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=CC=C3Cl

InChI=1SC19H20ClNO3Sc122419(23)161394351115(13)2518(16)2117(22)128671014(12)20h6810H25911H21H3(H2122)


BBL000757
Synonyms: ethyl2-{[(4-bromophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)Br)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)c2ccc(cc2)Br)sc2c1CCCC2

ethyl2(((4bromophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD00495501

ZINC000000974025

ZINC00974025

ZINC974025

119934213

ethyl2((4bromobenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=C(C=C3)Br

InChI=1SC18H18BrNO3Sc122318(22)1513534614(13)2417(15)2016(21)117912(19)10811h710H26H21H3(H2021)


BBL000758
Synonyms: ethyl2-{[(4-nitrophenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc2c1CCCCC2

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CCOC(=O)c1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc2c1CCCCC2

ethyl2(((4nitrophenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

MFCD00782618

ZINC000000861829

ZINC00861829

ZINC861829

331819604

ethyl2((4nitrobenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)

InChI=1SC19H20N2O5Sc122619(23)16146435715(14)2718(16)2017(22)1281013(11912)21(24)25h811H27H21H3(H2022)


BBL000759
Synonyms: ethyl2-[(phenylcarbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCCC2

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCCC2

ethyl2((phenylcarbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

MFCD00782617

ZINC000000035935

ZINC00035935

ZINC35935

63274522

ethyl2benzamido5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=CC=C3

InChI=1SC19H21NO3Sc122319(22)1614117481215(14)2418(16)2017(21)1395361013h356910H24781112H21H3(H2021)


BBL000760
Synonyms: 4-tert-butyl-N-[(2-chlorophenyl)carbamothioyl]benzamide
Smiles: S=C(Nc1ccccc1Cl)NC(=O)c1ccc(cc1)C(C)(C)C

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S=C(Nc1ccccc1Cl)NC(=O)c1ccc(cc1)C(C)(C)C

ZINC000000453980

ZINC00453980

ZINC453980

364628240

4TERTBUTYLN((2CHLOROPHENYL)CARBAMOTHIOYL)BENZAMIDE

MFCD03032332

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2Cl

InChI=1SC18H19ClN2OSc118(23)1310812(91113)16(22)2117(23)2015754614(15)19h411H13H3(H220212223)


BBL000761
Synonyms: diethyl2,3-dibromobutanedioate
Smiles: CCOC(=O)C(C(C(=O)OCC)Br)Br

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CCOC(=O)C(C(C(=O)OCC)Br)Br

DIETHYL(2R3R)23DIBROMOBUTANEDIOATE

DIETHYL(2R3S)23DIBROMOBUTANEDIOATE

DIETHYL(2S3S)23DIBROMOBUTANEDIOATE

DIETHYL23DIBROMOBUTANEDIOATE

DIETHYL23DIBROMOSUCCINATE

DLDIETHYL23DIBROMOSUCCINATE

23DIBROMOSUCCINICACIDDIETHYLESTER

608822

ALPHABETADIBROMOSUCCINICACIDDIETHYLESTER

MFCD00464548

ZINC000001691491

ZINC000001691493

InChI=1SC8H12Br2O4c13137(11)5(9)6(10)8(12)1442h56H34H212H3


BBL000762
Synonyms: 2-(2-hydroxy-4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1C2CC=CCC2C(=O)N1c1ccc(cc1O)[N+](=O)[O-]

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O=C1C2CC=CCC2C(=O)N1c1ccc(cc1O)(N+)(=O)(O)

ZINC000018227584

ZINC000100396900

MFCD05098767

2(2HYDROXY4NITROPHENYL)3A477ATETRAHYDRO1HISOINDOLE13(2H)DIONE

774189081

2(2hydroxy4nitrophenyl)3a477atetrahydroisoindole13dione

C1C=CCC2C1C(=O)N(C2=O)C3=C(C=C(C=C3)(N+)(=O)(O))O

InChI=1SC14H12N2O5c171278(16(20)21)5611(12)1513(18)9312410(9)14(15)19h125791017H34H2


BBL000763
Synonyms: (5Z)-5-[4-(dimethylamino)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CN(c1ccc(cc1)/C=C/1\SC(=S)NC1=O)C

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CN(c1ccc(cc1)C=C1SC(=S)NC1=O)C

(5Z)5((4(DIMETHYLAMINO)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE

(5Z)5((4DIMETHYLAMINOPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE

P(DIMETHYLAMINO)BENZAL5RHODANINE

P(DIMETHYLAMINO)BENZYLIDENERHODANINE

PDIMETHYLAMINOBENZALRHODANINE

PDIMETHYLAMINOBENZYLIDENERHODAMINE

RHODANINE5(P(DIMETHYLAMINO)BENZYLIDENE)

ZINC12358823

ZINC16990793

(5Z)5(4(DIMETHYLAMINO)BENZYLIDENE)2SULFANYL13THIAZOL4(5H)ONE

(5Z)5(4(DIMETHYLAMINO)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE

1134203147

4(DIMETHYLAMINO)BENZALRHODANINE

4DIMETHYLAMINOBENZALRHODANINE

4DIMETHYLAMINOBENZYLIDENERHODANINE

4DIMETHYLAMINOBENZYLINDENERHODANINE

4THIAZOLIDINONE5((4(DIMETHYLAMINO)PHENYL)METHYLENE)2THIOXO

5((4(DIMETHYLAMINO)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE

5((4(DIMETHYLAMINO)PHENYL)METHYLIDENE)2SULFANYLIDENE4THIAZOLIDINONE

5((E)(4(DIMETHYLAMINO)PHENYL)METHYLIDENE)2THIOXO13THIAZOLAN4ONE

5((Z)4(DIMETHYLAMINO)BENZYLIDENE)2THIOXOTHIAZOLIDINE4ONE

5(4(DIMETHYLAMINO)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE

5(4(DIMETHYLAMINO)BENZYLIDENE)2THIOXOTHIAZOLIDIN4ONE

5(4(DIMETHYLAMINO)BENZYLIDENE)RHODANINE

5(4DIMETHYLAMINOBENZYLIDENE)RHODANINE

5(4DIMETHYLAMINOBENZYLIDENE)RHODANINE98

5(P(DIMETHYLAMINO)BENZAL)RHODANINE

5(P(DIMETHYLAMINO)BENZOYLIDENE)RHODANINE

5(P(DIMETHYLAMINO)BENZYLIDENE)RHODANINE

5(PDIMETHYLAMINOBENZAL)RHODANINE

5(PDIMETHYLAMINOBENZOYLIDENE)RHODANINE

CN(C)C1=CC=C(C=C1)C=C2C(=O)NC(=S)S2

InChI=1SC12H12N2OS2c114(2)9538(469)71011(15)1312(16)1710h37H12H3(H131516)b107


BBL000764
Synonyms: 5-[(3-nitrophenyl)amino]-5-oxopentanoicacid
Smiles: O=C(Nc1cccc(c1)[N+](=O)[O-])CCCC(=O)O

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O=C(Nc1cccc(c1)(N+)(=O)(O))CCCC(=O)O

ZINC000000155065

ZINC155065

MFCD00029876

25901273

4((3NITROPHENYL)CARBAMOYL)BUTANOICACID

4(N(3NITROPHENYL)CARBAMOYL)BUTANOICACID

5((3NITROPHENYL)AMINO)5OXOPENTANOICACID

5(3NITROANILINO)5OXOPENTANOICACID

C1=CC(=CC(=C1)(N+)(=O)(O))NC(=O)CCCC(=O)O

InChI=1SC11H12N2O5c1410(52611(15)16)1283149(78)13(17)18h1347H256H2(H1214)(H1516)


BBL000765
Synonyms: 2-(3-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C(=O)C

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OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C(=O)C

ZINC000000066638

ZINC66638

MFCD00391891

2(3ACETYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLICACID

2(3ACETYLPHENYL)13DIOXOISOINDOLE5CARBOXYLICACID

300385040

CC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

InChI=1SC17H11NO5c19(19)1032412(710)1815(20)136511(17(22)23)814(13)16(18)21h28H1H3(H2223)


BBL000766
Synonyms: 5-phenyl-1,3,4-oxadiazole-2-thiol
Smiles: Sc1nnc(o1)c1ccccc1

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Sc1nnc(o1)c1ccccc1

ZINC395525

PHENY134OXADIAZOLE2THIOL

134OXADIAZOLE2(3H)THIONE5PHENYL

134OXADIAZOLE2THIOL5PHENYL

134OXADIAZOLE5THIOL2PHENYL

2FENIL5MERCAPTO134OSSADIAZOLO

2PHENYL134OXADIAZOL5THIOL

2PHENYL134OXADIAZOLE5THIOL

2PHENYL134OXADIAZOLINE5THIONE

2PHENYL5MERCAPTOOXADIAZOLE

3004420

5PHENYL(134)OXADIAZOLE2THIOL

5PHENYL134OCADIAZOLE2THIOL

5PHENYL134OXADIAZOL2YLHYDROSULFIDE

5PHENYL134OXADIAZOLE2(3H)THIONE

5PHENYL134OXADIAZOLE2(3H)THIONE(1)

5PHENYL134OXADIAZOLE2THIOL

5PHENYL134OXADIAZOLE2THIONE

5PHENYL134OXADIAZOLINE2THIONE

5PHENYL23DIHYDRO134OXADIAZOLE2THIONE

5PHENYL2MERCAPTO134OXADIAZOLE

5PHENYL3H134OXADIAZOLE2THIONE

C1=CC=C(C=C1)C2=NNC(=S)O2

InChI=1SC8H6N2OSc1281097(118)6421356h15H(H1012)


BBL000767
Synonyms: 5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2sc3c(c2c(=O)[nH]1)CCCC3

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O=c1(nH)c2sc3c(c2c(=O)(nH)1)CCCC3

5678tetrahydro(1)benzothieno(23d)pyrimidine24(1H3H)dione

ZINC00150162

ZINC150162

27285092

5678tetrahydro1H(1)benzothiolo(23d)pyrimidine24dione

C1CCC2=C(C1)C3=C(S2)NC(=O)NC3=O

InChI=1SC10H10N2O2Sc1387531246(5)159(7)1210(14)118h14H2(H211121314)


BBL000768
Synonyms: 4,4'-[(3-nitrophenyl)methanediyl]bis(2-chloroaniline)
Smiles: [O-][N+](=O)c1cccc(c1)C(c1ccc(c(c1)Cl)N)c1ccc(c(c1)Cl)N

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(O)(N+)(=O)c1cccc(c1)C(c1ccc(c(c1)Cl)N)c1ccc(c(c1)Cl)N

4((4AMINO3CHLOROPHENYL)(3NITROPHENYL)METHYL)2CHLOROANILINE

4((4AMINO3CHLOROPHENYL)(3NITROPHENYL)METHYL)2CHLOROPHENYLAMINE

40530265

44((3NITROPHENYL)METHANEDIYL)BIS(2CHLOROANILINE)

MFCD00368907

ZINC000004015916

ZINC04015916

ZINC4015916

C1=CC(=CC(=C1)(N+)(=O)(O))C(C2=CC(=C(C=C2)N)Cl)C3=CC(=C(C=C3)N)Cl

InChI=1SC19H15Cl2N3O2c2015912(4617(15)22)19(135718(23)16(21)1013)1121314(811)24(25)26h11019H2223H2


BBL000769
Synonyms: ethyl4,5-dimethyl-2-(propanoylamino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CC)sc(c1C)C

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CCOC(=O)c1c(NC(=O)CC)sc(c1C)C

ETHYL45DIMETHYL2(PROPANOYLAMINO)THIOPHENE3CARBOXYLATE

ETHYL45DIMETHYL2(PROPIONYLAMINO)3THIOPHENECARBOXYLATE

ETHYL45DIMETHYL2PROPANAMIDOTHIOPHENE3CARBOXYLATE

ETHYL45DIMETHYL2PROPIONAMIDO3THIOPHENECARBOXYLATE

MFCD00297441

ZINC000000227394

ZINC00227394

ZINC227394

45DIMETHYL2PROPIONYLAMINOTHIOPHENE3CARBOXYLICACIDETHYLESTER

72965174

CCC(=O)NC1=C(C(=C(S1)C)C)C(=O)OCC

InChI=1SC12H17NO3Sc159(14)131110(12(15)1662)7(3)8(4)1711h56H214H3(H1314)


BBL000770
Synonyms: 1,2-dimethylnaphtho[1,2-d][1,3]thiazol-1-ium
Smiles: Cc1sc2c([n+]1C)c1ccccc1cc2

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Cc1sc2c((n+)1C)c1ccccc1cc2

NAPHTHO(12D)THIAZOLIUM12DIMETHYL

ZINC00294936

ZINC294936

12DIMETHYL1LAMBDA(5)NAPHTHO(12D)(13)THIAZOLE

12DIMETHYL1LAMBDA5NAPHTHO(12D)(13)THIAZOLE

12DIMETHYLBENZO(E)(13)BENZOTHIAZOL1IUM

12DIMETHYLBENZO(E)BENZOTHIAZOLE

12DIMETHYLNAPHTHO(12D)(13)THIAZOL1IUM

12DIMETHYLNAPHTHO(12D)THIAZOL1IUM

12DIMETHYLNAPHTHO(12D)THIAZOL3IUM

CC1=(N+)(C2=C(S1)C=CC3=CC=CC=C32)C

InChI=1SC13H12NSc1914(2)1311643510(11)7812(13)159h38H12H3q+1


BBL000771
Synonyms: ethyl2-{[(4-methylphenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc(cc1)C

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CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc(cc1)C

ethyl2(((4methylphenyl)sulfonyl)amino)4567tetrahydro1benzothiophene3carboxylate

ZINC01025136

ZINC1025136

63183119


BBL000772
Synonyms: 1,3-dioxo-2-(4-phenoxyphenyl)-2,3-dihydro-1H-isoindole-5-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Oc1ccccc1

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OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)Oc1ccccc1

ZINC000000629812

ZINC629812

MFCD00360933

13DIOXO2(4PHENOXYPHENYL)23DIHYDRO1HISOINDOLE5CARBOXYLICACID

13DIOXO2(4PHENOXYPHENYL)ISOINDOLE5CARBOXYLICACID

306763600

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O

InChI=1SC21H13NO5c23191711613(21(25)26)1218(17)20(24)22(19)147916(10814)27154213515h112H(H2526)


BBL000773
Synonyms: 2-(2-hydroxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: O=C1C2C3CCC(C2C(=O)N1c1ccccc1O)C3

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O=C1C2C3CCC(C2C(=O)N1c1ccccc1O)C3

ZINC000004157434

ZINC000100629634

ZINC000239235484

(3AR4R7R7AS)2(2HYDROXYPHENYL)HEXAHYDRO1H47METHANOISOINDOLE13(2H)DIONE

2(2HYDROXYPHENYL)HEXAHYDRO1H47METHANOISOINDOLE13(2H)DIONE

474377349

MFCD01156384

C1CC2CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4O

InChI=1SC15H15NO3c1711421310(11)1614(18)128569(78)13(12)15(16)19h1489121317H57H2


BBL000774
Synonyms: 5-[(4-{[2-(3-nitrophenyl)-2-oxoethoxy]carbonyl}phenyl)amino]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)Nc1ccc(cc1)C(=O)OCC(=O)c1cccc(c1)[N+](=O)[O-]

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OC(=O)CCCC(=O)Nc1ccc(cc1)C(=O)OCC(=O)c1cccc(c1)(N+)(=O)(O)

ZINC000008473704

ZINC8473704

MFCD18170007

1207326940

5((4((2(3NITROPHENYL)2OXOETHOXY)CARBONYL)PHENYL)AMINO)5OXOPENTANOICACID

5(4(2(3nitrophenyl)2oxoethoxy)carbonylanilino)5oxopentanoicacid

C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)O

InChI=1SC20H18N2O8c2317(1431416(1114)22(28)29)123020(27)137915(10813)2118(24)52619(25)26h134711H25612H2(H2124)(H2526)


BBL000775
Synonyms: 2-(acetylamino)-4,5-dimethylthiophen-3-ylthiocyanate
Smiles: N#CSc1c(NC(=O)C)sc(c1C)C

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N#CSc1c(NC(=O)C)sc(c1C)C

N(3CYANOTHIO45DIMETHYL2THIENYL)ACETAMIDE

ZINC00497454

ZINC497454

(2ACETAMIDO45DIMETHYLTHIOPHEN3YL)THIOCYANATE

2(ACETYLAMINO)45DIMETHYLTHIOPHEN3YLTHIOCYANATE

54489893

CC1=C(SC(=C1SC#N)NC(=O)C)C

InChI=1SC9H10N2OS2c156(2)149(117(3)12)8(5)13410h13H3(H1112)


BBL000776
Synonyms: 3-amino-2-ethyl-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCc1nc2sc(c(c2c(=O)n1N)C)C

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CCc1nc2sc(c(c2c(=O)n1N)C)C

ZINC00126510

ZINC126510

3AMINO2ETHYL56DIMETHYL3HTHIENO(23D)PYRIMIDIN4ONE

3AMINO2ETHYL56DIMETHYL3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE

3AMINO2ETHYL56DIMETHYLTHIENO(23D)PYRIMIDIN4(3H)ONE

3AMINO2ETHYL56DIMETHYLTHIENO(23D)PYRIMIDIN4ONE

80381642

CCC1=NC2=C(C(=C(S2)C)C)C(=O)N1N

InChI=1SC10H13N3OSc1471298(10(14)13(7)11)5(2)6(3)159h411H213H3


BBL000777
Synonyms: ethyl(2E)-azepan-2-ylidene(cyano)ethanoate
Smiles: CCOC(=O)/C(=C/1\CCCCCN1)/C#N

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CCOC(=O)C(=C1CCCCCN1)C#N

ETHYL(2E)2(AZEPAN2YLIDENE)2CYANOACETATE

ETHYL(2E)AZEPAN2YLIDENE(CYANO)ETHANOATE

ETHYL2AZAPERHYDROEPIN2YLIDENE2CYANOACETATE

103639936

AZEPAN2YLIDENECYANOACETICACIDETHYLESTER

MFCD01872623

ZINC000019855147

ZINC19855147

InChI=1SC11H16N2O2c121511(14)9(812)10643571310h13H27H21H3b109+


BBL000778
Synonyms:
Smiles: Oc1ccc(cc1CC[N](C)(C)C)Br

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Oc1ccc(cc1CC(N)(C)(C)C)Br




BBL000779
Synonyms: methyl(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetate
Smiles: COC(=O)CN1C(=O)c2c(S1(=O)=O)cccc2

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COC(=O)CN1C(=O)c2c(S1(=O)=O)cccc2

12BENZISOTHIAZOLE2(3H)ACETICACID3OXOMETHYLESTER11DIOXIDE

12BENZOISOTHIAZOL2(3H)ACETICACID3OXOMETHYLESTER11DIOXIDE

2(METHOXYCARBONYLMETHYL)12BENZISOTHIAZOL3(2H)ONE11DIOXIDE

3OXO12BENZOISOTHIAZOLINE2ACETICACIDMETHYLESTER11DIOXIDE(PIROXICAMIMPURITYD)

6639629

METHYL(11DIOXIDO3OXO12BENZISOTHIAZOL2(3H)YL)ACETATE

METHYL(11DIOXIDO3OXO12BENZOTHIAZOL2(3H)YL)ACETATE

METHYL2(113TRIOXO12BENZOTHIAZOL2YL)ACETATE

METHYL2(113TRIOXO23DIHYDRO1

METHYL2(113TRIOXO23DIHYDRO1E2BENZOTHIAZOL2YL)ACETATE

METHYL3OXO12BENZISOTHIAZOLE2(3H)ACETATE11DIOXIDE

MFCD00071807

PIROXICAMIMPURITYD

SACCHARINN(2ACETICACIDMETHYLESTER)

ZINC000000155602

ZINC00155602

ZINC155602

COC(=O)CN1C(=O)C2=CC=CC=C2S1(=O)=O

InChI=1SC10H9NO5Sc1169(12)61110(13)742358(7)17(1114)15h25H6H21H3


BBL000780
Synonyms: 3-benzyldihydrofuran-2,5-dione
Smiles: O=C1OC(=O)CC1Cc1ccccc1

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O=C1OC(=O)CC1Cc1ccccc1

SUCCINICANHYDRIDEBENZYL

ZINC000100023878

ZINC000100023879

DIHYDRO3(PHENYLMETHYL)25FURANDIONE

DLBENZYLSUCCINICANHYDRIDE

MFCD00157369

19544435

25FURANDIONEDIHYDRO3(PHENYLMETHYL)

2BENZYLSUCCINICANHYDRIDE

2BENZYLSUCCINICANHYDRIDEDL

34DIHYDRO3(PHENYLMETHYL)25FURANDIONE

3BENZYL34DIHYDROFURAN25DIONE

3BENZYLDIHYDROFURAN25DIONE

3BENZYLOXOLANE25DIONE

3BENZYLSUCCINICANHYDRIDE

ALPHABENZYLSUCCINICANHYDRIDE

BENZYLBUTANEDIOICACIDANHYDRIDE

C1C(C(=O)OC1=O)CC2=CC=CC=C2

InChI=1SC11H10O3c121079(11(13)1410)68421358h159H67H2


BBL000781
Synonyms: 3-(2-aminoethyl)-5-(benzyloxy)-1H-indole-2-carboxylicacid
Smiles: NCCc1c([nH]c2c1cc(OCc1ccccc1)cc2)C(=O)O

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NCCc1c((nH)c2c1cc(OCc1ccccc1)cc2)C(=O)O

ZINC000000187820

ZINC00187820

ZINC187820

MFCD00397171

1HINDOLE2CARBOXYLICACID3(2AMINOETHYL)5(PHENYLMETHOXY)

3(2AMINOETHYL)5(BENZYLOXY)1HINDOLE2CARBOXYLICACID

3(2AMINOETHYL)5(PHENYLMETHOXY)INDOLE2CARBOXYLICACID

3(2AMINOETHYL)5PHENYLMETHOXY1HINDOLE2CARBOXYLICACID

3(2AZANIUMYLETHYL)5PHENYLMETHOXY1HINDOLE2CARBOXYLATE

54987143

C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC(=C3CC(NH3+))C(=O)(O)

InChI=1SC18H18N2O3c199814151013(2311124213512)6716(15)2017(14)18(21)22h171020H891119H2(H2122)


BBL000782
Synonyms: N-(pyridin-3-ylmethyl)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanamine
Smiles: CC(C12CC3CC(C2)CC(C1)C3)NCc1cccnc1

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CC(C12CC3CC(C2)CC(C1)C3)NCc1cccnc1

N(pyridin3ylmethyl)1(tricyclo(3311~37~)dec1yl)ethanamine

ZINC000004168182

ZINC000004168183

(1(ADAMANTAN1YL)ETHYL)(PYRIDIN3YLMETHYL)AMINE

(1ADAMANTAN1YLETHYL)PYRIDIN3YLMETHYLAMINE

(ADAMANTANYLETHYL)(3PYRIDYLMETHYL)AMINE

1(1ADAMANTYL)N(PYRIDIN3YLMETHYL)ETHANAMINE

1055927611

MFCD03108535

CC(C12CC3CC(C1)CC(C3)C2)NCC4=CN=CC=C4

InChI=1SC18H26N2c113(201214324191114)18815516(918)717(615)1018h241113151720H51012H21H3


BBL000783
Synonyms: 4-methyl-3-[(thiophen-2-ylcarbonyl)amino]benzoicacid
Smiles: Cc1ccc(cc1NC(=O)c1cccs1)C(=O)O

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Cc1ccc(cc1NC(=O)c1cccs1)C(=O)O

MFCD01025801

ZINC000000183804

ZINC183804

313260445

4METHYL3((THIEN2YLCARBONYL)AMINO)BENZOICACID

4METHYL3((THIOPHEN2YLCARBONYL)AMINO)BENZOICACID

4METHYL3((THIOPHENE2CARBONYL)AMINO)BENZOICACID

4METHYL3(2THIENYLCARBONYLAMINO)BENZOICACID

4METHYL3(THIOPHENE2CARBONYLAMINO)BENZOICACID

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC=CS2

InChI=1SC13H11NO3Sc18459(13(16)17)710(8)1412(15)113261811h27H1H3(H1415)(H1617)


BBL000784
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanamine
Smiles: CC(C12CC3CC(C2)CC(C1)C3)NCc1ccc2c(c1)OCO2

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CC(C12CC3CC(C2)CC(C1)C3)NCc1ccc2c(c1)OCO2

N(13benzodioxol5ylmethyl)1(tricyclo(3311~37~)dec1yl)ethanamine

ZINC000004298686

ZINC000004298687

MFCD01831606

N(1(1ADAMANTYL)ETHYL)N(13BENZODIOXOL5YLMETHYL)AMINE

(1(ADAMANTAN1YL)ETHYL)(2H13BENZODIOXOL5YLMETHYL)AMINE

(1ADAMANTAN1YLETHYL)BENZO(13)DIOXOL5YLMETH

(1ADAMANTAN1YLETHYL)BENZO(13)DIOXOL5YLMETHYLAMINE

(ADAMANTANYLETHYL)(2HBENZO(34D)13DIOXOLEN5YLMETHYL)AMINE

1(1ADAMANTYL)N(13BENZODIOXOL5YLMETHYL)ETHANAMINE

1048343710

CC(C12CC3CC(C1)CC(C3)C2)NCC4=CC5=C(C=C4)OCO5

InChI=1SC20H27NO2c113(20815416(920)617(515)1020)211114231819(714)23122218h23713151721H46812H21H3


BBL000785
Synonyms: 2-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoicacid
Smiles: CCCCC(N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])C(=O)O

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CCCCC(N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O))C(=O)O

MFCD00603471

ZINC000002502215

ZINC000004162333

18635933

2(4NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)HEXANOICACID

2(4NITRO13DIOXOISOINDOL2YL)HEXANOICACID

CCCCC(C(=O)O)N1C(=O)C2=C(C1=O)C(=CC=C2)(N+)(=O)(O)

InChI=1SC14H14N2O6c123610(14(19)20)1512(17)85479(16(21)22)11(8)13(15)18h45710H236H21H3(H1920)


BBL000786
Synonyms: 3-(2-hydroxyethyl)-2-methyl-1,3-benzothiazol-3-ium
Smiles: OCC[n+]1c(C)sc2c1cccc2

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OCC(n+)1c(C)sc2c1cccc2

ZINC000000226087

ZINC00226087

ZINC226087

2(2METHYL13BENZOTHIAZOL3IUM3YL)ETHANOL

2METHYL3(2HYDROXYETHYL)BENZOTHIAZOLIUM

3(2HYDROXYETHYL)2METHYL13BENZOTHIAZOL3IUM

3(2HYDROXYETHYL)2METHYLBENZOTHIAZOL3IUM

60126309

MFCD00600556

CC1=(N+)(C2=CC=CC=C2S1)CCO

InChI=1SC10H12NOSc1811(6712)9423510(9)138h2512H67H21H3q+1


BBL000787
Synonyms: ethyl1,3-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1c(C)c2c(n1C)CCCC2=O

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CCOC(=O)c1c(C)c2c(n1C)CCCC2=O

ethyl13dimethyl4oxo4567tetrahydro1Hindole2carboxylate

ETHYL13DIMETHYL4OXO67DIHYDRO5HINDOLE2CARBOXYLATE

MFCD00451596

ZINC000000213119

ZINC00213119

ZINC213119

14006827

CCOC(=O)C1=C(C2=C(N1C)CCCC2=O)C

InChI=1SC13H17NO3c141713(16)128(2)119(14(12)3)65710(11)15h47H213H3


BBL000788
Synonyms: 5-[(4'-nitrobiphenyl-4-yl)amino]-5-oxopentanoicacid
Smiles: O=C(Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])CCCC(=O)O

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O=C(Nc1ccc(cc1)c1ccc(cc1)(N+)(=O)(O))CCCC(=O)O

ZINC8433947

5((4NITROBIPHENYL4YL)AMINO)5OXOPENTANOICACID


BBL000789
Synonyms: diethyl5-aminothiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1sc(c(c1)C(=O)OCC)N

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CCOC(=O)c1sc(c(c1)C(=O)OCC)N

DIETHYL5AMINOTHIOPHENE24DICARBOXYLATE

ETHYL2AMINO5(ETHOXYCARBONYL)THIOPHENE3CARBOXYLATE

208122412

ZINC00195156

ZINC195156

CCOC(=O)C1=CC(=C(S1)N)C(=O)OCC

InChI=1SC10H13NO4Sc13149(12)657(168(6)11)10(13)1542h5H3411H212H3


BBL000790
Synonyms: 4-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-4-oxobutanoicacid
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CCC(=O)O

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O=C(Nc1cc(ccc1Cl)C(F)(F)F)CCC(=O)O

ZINC000000196820

ZINC196820

MFCD00157413

N(2CHLORO5TRIFLUOROMETHYLPHENYL)SUCCINAMICACID

199803991

3((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)PROPANOICACID

3(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)PROPANOICACID

4((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)4OXOBUTANOICACID

4(2CHLORO5(TRIFLUOROMETHYL)ANILINO)4OXOBUTANOICACID

C1=CC(=C(C=C1C(F)(F)F)NC(=O)CCC(=O)O)Cl

InChI=1SC11H9ClF3NO3c127216(11(1314)15)58(7)169(17)3410(18)19h125H34H2(H1617)(H1819)


BBL000791
Synonyms: N-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-8-yl)formamide
Smiles: O=CNC1CCCc2c1sc1c2c(=O)[nH]cn1

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O=CNC1CCCc2c1sc1c2c(=O)(nH)cn1

N(4oxo345678hexahydro(1)benzothieno(23d)pyrimidin8yl)formamide


BBL000792
Synonyms: (1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)aceticacid
Smiles: OC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2

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OC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2

((3AR4R4AR5AS6S6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)ACETICACID

(13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)ACETICACID

381230348

C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CC(=O)O

InChI=1SC13H13NO4c159(16)41412(17)105126(837(5)8)11(10)13(14)18h12581011H34H2(H1516)


BBL000793
Synonyms: 7-bromo-6-hydroxy-2,3-dihydro[1]benzothieno[2,3-d]pyrrolo[1,2-a]pyrimidin-10(1H)-one
Smiles: Brc1ccc2c(c1O)sc1c2c(=O)n2c(n1)CCC2

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Brc1ccc2c(c1O)sc1c2c(=O)n2c(n1)CCC2

BROMO(HYDROXY)()ONE

(1)BENZOTHIENO(23D)PYRROLO(12A)PYRIMIDIN10(1H)ONE7BROMO23DIHYDRO6HYDROXY

136800743

7BROMO12DIHYDRO6HYDROXY(1)BENZOTHIENO(23D)PYRROLO(12A)PYRIMIDIN10(3H)ONE

7BROMO6HYDROXY23DIHYDRO(1)BENZOTHIENO(23D)PYRROLO(12A)PYRIMIDIN10(1H)ONE

7BROMO8HYDROXY23DIHYDRO1H9THIA3A10DIAZACYCLOPENTA(B)FLUOREN4ONE

MFCD00437061

ZINC000000195167

ZINC00195167

ZINC195167

C1CC2=NC3=C(C4=C(S3)C(=C(C=C4)Br)O)C(=O)N2C1

InChI=1SC13H9BrN2O2Sc147436912(1911(6)10(7)17)15821516(8)13(9)18h3417H125H2


BBL000794
Synonyms: 2-methyl-5-phenyl-4H-thieno[2,3-d][1,3]oxazin-4-one
Smiles: Cc1oc(=O)c2c(n1)scc2c1ccccc1

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Cc1oc(=O)c2c(n1)scc2c1ccccc1

ZINC00284282

ZINC284282

13130455

2METHYL5PHENYL4HTHIENO(23D)(13)OXAZIN4ONE

2METHYL5PHENYLTHIENO(23D)(13)OXAZIN4ONE

2METHYL5PHENYLTHIOPHENO(23D)13OXAZIN4ONE

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)O1

InChI=1SC13H9NO2Sc18141211(13(15)168)10(71712)9532469h27H1H3


BBL000795
Synonyms: ethyl2-(acetylamino)-7-hydroxy-4,6-dinitro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1c(cc(c2O)[N+](=O)[O-])[N+](=O)[O-]

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CCOC(=O)c1c(NC(=O)C)sc2c1c(cc(c2O)(N+)(=O)(O))(N+)(=O)(O)

ETHYL2(ACETYLAMINO)7HYDROXY46BISNITRO1BENZOTHIOPHENE3CARBOXYLATE

ETHYL2(ACETYLAMINO)7HYDROXY46DINITRO1BENZOTHIOPHENE3CARBOXYLATE

ETHYL2(ACETYLAMINO)7HYDROXY46DINITROBENZO(B)THIOPHENE3CARBOXYLATE

ETHYL2ACETAMIDO7HYDROXY46DINITRO1BENZOTHIOPHENE3CARBOXYLATE

113408041

MFCD00377734

ZINC000008781317

ZINC8781317

CCOC(=O)C1=C(SC2=C1C(=CC(=C2O)(N+)(=O)(O))(N+)(=O)(O))NC(=O)C

InChI=1SC13H11N3O8Sc132413(19)986(15(20)21)47(16(22)23)10(18)11(8)2512(9)145(2)17h418H3H212H3(H1417)


BBL000796
Synonyms: ethyl2-[(methoxycarbonyl)amino]-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)OC)sc2c1CCCC2=O

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CCOC(=O)c1c(NC(=O)OC)sc2c1CCCC2=O

ethyl2((methoxycarbonyl)amino)7oxo4567tetrahydro1benzothiophene3carboxylate

ETHYL2(METHOXYCARBONYLAMINO)7OXO456TRIHYDROBENZO(B)THIOPHENE3CARBOXYLATE

356586624

MFCD00426583

ZINC000013941923

ZINC13941923

ethyl2(methoxycarbonylamino)7oxo56dihydro4H1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)OC

InChI=1SC13H15NO5Sc131912(16)975468(15)10(7)2011(9)1413(17)182h36H212H3(H1417)


BBL000797
Synonyms: ethyl7-(acetylamino)-2-amino-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)sc2c1cccc2NC(=O)C

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CCOC(=O)c1c(N)sc2c1cccc2NC(=O)C

ETHYL7(ACETYLAMINO)2AMINO1BENZOTHIOPHENE3CARBOXYLATE

ETHYL7ACETAMIDO2AMINO1BENZOTHIOPHENE3CARBOXYLATE

ETHYL7ACETAMIDO2AMINOBENZO(B)THIOPHENE3CARBOXYLATE

MFCD00437064

ZINC000000365824

ZINC00365824

ZINC365824

108940165

7ACETYLAMINO2AMINOBENZO(B)THIOPHENE3CARBOXYLICACIDETHYLESTER

CCOC(=O)C1=C(SC2=C1C=CC=C2NC(=O)C)N

InChI=1SC13H14N2O3Sc131813(17)1085469(157(2)16)11(8)1912(10)14h46H314H212H3(H1516)


BBL000798
Synonyms: ethyl(4Z)-4-(hydroxyimino)-1,3-dimethyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1c(C)c2c(n1C)CCC/C/2=N/O

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CCOC(=O)c1c(C)c2c(n1C)CCCC2=NO

ethyl(4Z)4(hydroxyimino)13dimethyl4567tetrahydro1Hindole2carboxylate

ETHYL(4Z)4HYDROXYIMINO13DIMETHYL67DIHYDRO5HINDOLE2CARBOXYLATE

342805758

MFCD09222978

ZINC000013116628

ZINC100308370

CCOC(=O)C1=C(C2=C(N1C)CCCC2=NO)C

InChI=1SC13H18N2O3c141813(16)128(2)119(1417)65710(11)15(12)3h17H47H213H3b149


BBL000799
Synonyms: ethyl2-(acetylamino)-7-chloro-6-formyl-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2Cl)C=O

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CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2Cl)C=O

ETHYL2(ACETYLAMINO)7CHLORO6FORMYL1BENZOTHIOPHENE3CARBOXYLATE

ETHYL2ACETAMIDO7CHLORO6FORMYL1BENZOTHIOPHENE3CARBOXYLATE

MFCD00416960

ZINC000000281700

ZINC00281700

ZINC281700

137987747

2(ACETYLAMINO)6FORMYL7CHLOROBENZO(B)THIOPHENE3CARBOXYLICACIDETHYLESTER

CCOC(=O)C1=C(SC2=C1C=CC(=C2Cl)C=O)NC(=O)C

InChI=1SC14H12ClNO4Sc132014(19)109548(617)11(15)12(9)2113(10)167(2)18h46H3H212H3(H1618)


BBL000800
Synonyms: 4-chloro-N-[3-(hydrazinylcarbonyl)-4,5-dimethylthiophen-2-yl]benzamide
Smiles: NNC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C

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NNC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C

ZINC000000365797

ZINC00365797

ZINC365797

299962360

4CHLORON(3(HYDRAZINECARBONYL)45DIMETHYLTHIOPHEN2YL)BENZAMIDE

4CHLORON(3(HYDRAZINYLCARBONYL)45DIMETHYLTHIOPHEN2YL)BENZAMIDE

MFCD00299142

N(345DIMETHYL(2THIENYL))(4CHLOROPHENYL)CARBOXAMIDE

CC1=C(SC(=C1C(=O)NN)NC(=O)C2=CC=C(C=C2)Cl)C

InChI=1SC14H14ClN3O2Sc178(2)2114(11(7)13(20)1816)1712(19)93510(15)649h36H16H212H3(H1719)(H1820)


BBL000801
Synonyms: ethyl4-(acetyloxy)-3-methyl-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)c(ccc2)OC(=O)C

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CCOC(=O)c1oc2c(c1C)c(ccc2)OC(=O)C

ETHYL4(ACETYLOXY)3METHYL1BENZOFURAN2CARBOXYLATE

ETHYL4ACETOXY3METHYLBENZOFURAN2CARBOXYLATE

ETHYL4ACETYLOXY3METHYL1BENZOFURAN2CARBOXYLATE

2(ETHOXYCARBONYL)3METHYLBENZO(B)FURAN4YLACETATE

4ACETOXY3METHYLBENZOFURAN2CARBOXYLICACIDETHYLESTER

73751129

MFCD01141547

ZINC000000291521

ZINC00291521

ZINC291521

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OC(=O)C)C

InChI=1SC14H14O5c141714(16)138(2)1210(189(3)15)65711(12)1913h57H4H213H3


BBL000802
Synonyms: ethyl5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)C

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CCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)C

ETHYL5(ACETYLOXY)2METHYL1BENZOFURAN3CARBOXYLATE

ETHYL5ACETOXY2METHYLBENZOFURAN3CARBOXYLATE

ETHYL5ACETYLOXY2METHYL1BENZOFURAN3CARBOXYLATE

3(ETHOXYCARBONYL)2METHYLBENZO(B)FURAN5YLACETATE

56820123

5ACETOXY2METHYLBENZOFURAN3CARBOXYLICACIDETHYLESTER

MFCD00430847

ZINC000000291514

ZINC00291514

ZINC291514

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)C)C

InChI=1SC14H14O5c141714(16)138(2)18126510(711(12)13)199(3)15h57H4H213H3


BBL000803
Synonyms: 12-amino-6,7,8,9-tetrachloro-1,2,3,4-tetrahydro-4a,10a-(epithioetheno)oxanthrene-11-carboxamide
Smiles: Clc1c2OC34CCCCC4(Oc2c(c(c1Cl)Cl)Cl)SC(=C3C(=O)N)N

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Clc1c2OC34CCCCC4(Oc2c(c(c1Cl)Cl)Cl)SC(=C3C(=O)N)N

12amino6789tetrachloro1234tetrahydro4a10a(epithioetheno)oxanthrene11carboxamide

924967533

MFCD00293772

ZINC000020018508

ZINC000101023411

C1CCC23C(C1)(C(=C(S2)N)C(=O)N)OC4=C(O3)C(=C(C(=C4Cl)Cl)Cl)Cl

InChI=1SC15H12Cl4N2O3Sc1667(17)9(19)1110(8(6)18)2314312415(142411)2513(21)5(14)12(20)22h1421H2(H22022)


BBL000804
Synonyms: 3-bromo-4-hydroxy-8,9,10,11-tetrahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(7H)-one
Smiles: Oc1c(Br)ccc2c1sc1c2c(=O)n2c(n1)CCCCC2

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Oc1c(Br)ccc2c1sc1c2c(=O)n2c(n1)CCCCC2

3bromo4hydroxy891011tetrahydro(1)benzothieno(2345)pyrimido(12a)azepin13(7H)one

136824981

MFCD00416963

ZINC000000754392

ZINC00754392

ZINC754392

C1CCC2=NC3=C(C4=C(S3)C(=C(C=C4)Br)O)C(=O)N2CC1

InChI=1SC15H13BrN2O2Sc1696581114(2113(8)12(9)19)17104213718(10)15(11)20h5619H147H2


BBL000805
Synonyms: ethyl7-oxo-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2=O)n1cccc1

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CCOC(=O)c1c(sc2c1CCCC2=O)n1cccc1

ethyl7oxo2(1Hpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate

ETHYL7OXO2PYRROL1YL56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE

MFCD00427049

ZINC000000188461

ZINC00188461

ZINC188461

328012799

CCOC(=O)C1=C(SC2=C1CCCC2=O)N3C=CC=C3

InChI=1SC15H15NO3Sc121915(18)121065711(17)13(10)2014(12)16834916h3489H257H21H3


BBL000806
Synonyms: 4-hydroxy-2,3,4,7,8,9,10,11-octahydro[1]benzothieno[2',3':4,5]pyrimido[1,2-a]azepin-13(1H)-one
Smiles: OC1CCCc2c1sc1c2c(=O)n2c(n1)CCCCC2

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OC1CCCc2c1sc1c2c(=O)n2c(n1)CCCCC2

4hydroxy2347891011octahydro(1)benzothieno(2345)pyrimido(12a)azepin13(1H)one

333774268

C1CCC2=NC3=C(C4=C(S3)C(CCC4)O)C(=O)N2CC1

InChI=1SC15H18N2O2Sc181064591214(2013(9)10)16117213817(11)15(12)19h1018H18H2


BBL000807
Synonyms: N-[3-(hydrazinylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Smiles: NNC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCC2

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NNC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCCC2

N(3(hydrazinylcarbonyl)4567tetrahydro1benzothiophen2yl)benzamide

ZINC000000247905

ZINC00247905

ZINC247905

73696421

MFCD00406496

N(3(hydrazinecarbonyl)4567tetrahydro1benzothiophen2yl)benzamide

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)NN

InChI=1SC16H17N3O2Sc171915(21)1311845912(11)2216(13)1814(20)106213710h1367H458917H2(H1820)(H1921)


BBL000808
Synonyms: N'-[(4-methylphenyl)sulfonyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)NNC(=O)c1csc2c1CCCC2

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Cc1ccc(cc1)S(=O)(=O)NNC(=O)c1csc2c1CCCC2

N((4methylphenyl)sulfonyl)4567tetrahydro1benzothiophene3carbohydrazide

ZINC000000850535

ZINC00850535

ZINC850535

136790426

MFCD00300774

N(4methylphenyl)sulfonyl4567tetrahydro1benzothiophene3carbohydrazide

CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C2=CSC3=C2CCCC3

InChI=1SC16H18N2O3S2c1116812(9711)23(2021)181716(19)14102215532413(14)15h61018H25H21H3(H1719)


BBL000809
Synonyms: ethyl2-{[3-(acetylsulfanyl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCSC(=O)C)sc2c1CCCC2

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CCOC(=O)c1c(NC(=O)CCSC(=O)C)sc2c1CCCC2

ethyl2((3(acetylsulfanyl)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate

MFCD01241979

ZINC000000653267

ZINC00653267

ZINC653267

333774291

ethyl2(3acetylsulfanylpropanoylamino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCSC(=O)C

InChI=1SC16H21NO4S2c132116(20)1411645712(11)2315(14)1713(19)892210(2)18h39H212H3(H1719)


BBL000810
Synonyms: ethyl5-acetyl-2-(acetylamino)-4-(4-nitrophenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc(c1c1ccc(cc1)[N+](=O)[O-])C(=O)C

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CCOC(=O)c1c(NC(=O)C)sc(c1c1ccc(cc1)(N+)(=O)(O))C(=O)C

ETHYL2ACETAMIDO5ACETYL4(4NITROPHENYL)THIOPHENE3CARBOXYLATE

ETHYL5ACETYL2(ACETYLAMINO)4(4NITROPHENYL)THIOPHENE3CARBOXYLATE

MFCD00769536

ZINC000000711988

ZINC00711988

ZINC711988

331275468

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)C)NC(=O)C

InChI=1SC17H16N2O6Sc142517(22)1413(115712(8611)19(23)24)15(9(2)20)2616(14)1810(3)21h58H4H213H3(H1821)


BBL000811
Synonyms: ethyl5-[(E)-(tert-butylimino)methyl]-4-chloro-3-methyl-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)c(Cl)c(cc2)/C=N/C(C)(C)C

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CCOC(=O)c1oc2c(c1C)c(Cl)c(cc2)C=NC(C)(C)C

ethyl5((E)(tertbutylimino)methyl)4chloro3methyl1benzofuran2carboxylate

MFCD00405967

ZINC000017903297

329059601


BBL000812
Synonyms: diethyl3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2,9-dicarboxylate
Smiles: CCOC(=O)C1CCCn2c1nc1sc(c(c1c2=O)C)C(=O)OCC

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CCOC(=O)C1CCCn2c1nc1sc(c(c1c2=O)C)C(=O)OCC

diethyl3methyl4oxo6789tetrahydro4Hpyrido(12a)thieno(23d)pyrimidine29dicarboxylate

ETHYL9(ETHOXYCARBONYL)3METHYL4OXO5HYDROPIPERIDINO(12A)THIOPHENO(23D)PYRIMIDINE2CARBOXYLATE

329059805

MFCD00377735

ZINC000000626309

ZINC000000626311

CCOC(=O)C1CCCN2C1=NC3=C(C2=O)C(=C(S3)C(=O)OCC)C

InChI=1SC17H20N2O5Sc142316(21)107681913(10)181411(15(19)20)9(3)12(2514)17(22)2452h10H48H213H3


BBL000813
Synonyms: N-[(1-phenyl-1H-pyrrol-2-yl)methyl]cyclohexanamine
Smiles: C1CCC(CC1)NCc1cccn1c1ccccc1

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C1CCC(CC1)NCc1cccn1c1ccccc1

CYCLOHEXYL((1PHENYLPYRROL2YL)METHYL)AMINE

CYCLOHEXYL(1PHENYL1HPYRROL2YLMETHYL)AMINE

MFCD00468924

N((1PHENYL1HPYRROL2YL)METHYL)CYCLOHEXANAMINE

N((1PHENYLPYRROL2YL)METHYL)CYCLOHEXANAMINE

NCYCLOHEXYLN((1PHENYL1HPYRROL2YL)METHYL)AMINE

PYRROLE2METHANAMINE1PHENYLNCYCLOHEXYL

ZINC000000033052

ZINC33052

296247604

C1CCC(CC1)NCC2=CC=CN2C3=CC=CC=C3

InChI=1SC17H22N2c13815(941)1814171271319(17)16105261116h25710131518H1348914H2


BBL000814
Synonyms: ethyl2-[(2Z)-2-(1-ethoxy-1,3-dioxobutan-2-ylidene)hydrazinyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)/C(=N\Nc1sc2c(c1C(=O)OCC)CCCC2)/C(=O)C

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CCOC(=O)C(=NNc1sc2c(c1C(=O)OCC)CCCC2)C(=O)C

ethyl2((2Z)2(1ethoxy13dioxobutan2ylidene)hydrazinyl)4567tetrahydro1benzothiophene3carboxylate

MFCD00846169

ZINC000000977795

ZINC100206165

72625015

CCOC(=O)C1=C(SC2=C1CCCC2)NN=C(C(=O)C)C(=O)OCC

InChI=1SC17H22N2O5Sc142316(21)1311867912(11)2515(13)191814(10(3)20)17(22)2452h19H49H213H3b1814


BBL000815
Synonyms: ethyl2-{[3-(acetylsulfanyl)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCSC(=O)C)sc2c1CCCCC2

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CCOC(=O)c1c(NC(=O)CCSC(=O)C)sc2c1CCCCC2

ethyl2((3(acetylsulfanyl)propanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

MFCD01241975

ZINC000004350938

ZINC04350938

ZINC4350938

352554600

ethyl2(3acetylsulfanylpropanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CCSC(=O)C

InChI=1SC17H23NO4S2c132217(21)15127546813(12)2416(15)1814(20)9102311(2)19h310H212H3(H1820)


BBL000816
Synonyms: ethyl2-{[N-(2-hydroxyethyl)-N-methyl-beta-alanyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: OCCN(CCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2)C

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OCCN(CCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2)C

ethyl2((N(2hydroxyethyl)Nmethylbetaalanyl)amino)4567tetrahydro1benzothiophene3carboxylate

356586737

ZINC000002075366

ZINC2075366

MFCD01241943

ethyl2(3(2hydroxyethyl(methyl)amino)propanoylamino)4567tetrahydro1benzothiophene3carboxylate

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCN(C)CCO

InChI=1SC17H26N2O4Sc132317(22)1512645713(12)2416(15)1814(21)8919(2)101120h20H311H212H3(H1821)


BBL000817
Synonyms: ethyl6-bromo-7-hydroxy-2-[(phenylcarbonyl)amino]-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1ccc(c2O)Br

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CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1ccc(c2O)Br

ETHYL2(BENZOYLAMINO)6BROMO7HYDROXY1BENZOTHIOPHENE3CARBOXYLATE

ETHYL2BENZAMIDO6BROMO7HYDROXY1BENZOTHIOPHENE3CARBOXYLATE

ETHYL6BROMO7HYDROXY2((PHENYLCARBONYL)AMINO)1BENZOTHIOPHENE3CARBOXYLATE

MFCD00292891

ZINC000000728254

ZINC00728254

ZINC728254

113407946

CCOC(=O)C1=C(SC2=C1C=CC(=C2O)Br)NC(=O)C3=CC=CC=C3

InChI=1SC18H14BrNO4Sc122418(23)13118912(19)14(21)15(11)2517(13)2016(22)106435710h3921H2H21H3(H2022)


BBL000818
Synonyms: N-[3-(hydrazinylcarbonyl)-4-phenylthiophen-2-yl]benzamide
Smiles: NNC(=O)c1c(scc1c1ccccc1)NC(=O)c1ccccc1

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NNC(=O)c1c(scc1c1ccccc1)NC(=O)c1ccccc1

PHENYLN(34PHENYL(2THIENYL))CARBOXAMIDE

ZINC000003141991

ZINC03141991

ZINC3141991

MFCD00301624

N(3(HYDRAZINECARBONYL)4PHENYLTHIOPHEN2YL)BENZAMIDE

N(3(HYDRAZINOCARBONYL)4PHENYL2THIENYL)BENZAMIDE

N(3(HYDRAZINYLCARBONYL)4PHENYLTHIOPHEN2YL)BENZAMIDE

73696432

C1=CC=C(C=C1)C2=CSC(=C2C(=O)NN)NC(=O)C3=CC=CC=C3

InChI=1SC18H15N3O2Sc192117(23)1514(127314812)112418(15)2016(22)1395261013h111H19H2(H2022)(H2123)


BBL000819
Synonyms: ethyl2-{[(4-chlorophenyl)carbonyl]amino}-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc2c1CCCC2=O

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CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc2c1CCCC2=O

ethyl2(((4chlorophenyl)carbonyl)amino)7oxo4567tetrahydro1benzothiophene3carboxylate

ETHYL2((4CHLOROBENZOYL)AMINO)7OXO56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE

MFCD00377737

ZINC000000978491

ZINC00978491

ZINC978491

299962451

CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)C3=CC=C(C=C3)Cl

InChI=1SC18H16ClNO4Sc122418(23)141243513(21)15(12)2517(14)2016(22)106811(19)9710h69H25H21H3(H2022)


BBL000820
Synonyms: 2-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1ccc(c(c1)OC)/C=N/c1sc2c(c1C#N)CCCC2

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COc1ccc(c(c1)OC)C=Nc1sc2c(c1C#N)CCCC2

2(((E)(24dimethoxyphenyl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile

356586759

MFCD00812103

ZINC000000296252

2((E)(24dimethoxyphenyl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile

COC1=CC(=C(C=C1)C=NC2=C(C3=C(S2)CCCC3)C#N)OC

InChI=1SC18H18N2O2Sc121138712(16(913)222)11201815(1019)14534617(14)2318h7911H36H212H3b2011+


BBL000821
Synonyms: ethyl4-{[(2-chlorophenyl)carbonyl]oxy}-3-methyl-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)c(ccc2)OC(=O)c1ccccc1Cl

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CCOC(=O)c1oc2c(c1C)c(ccc2)OC(=O)c1ccccc1Cl

ETHYL4(((2CHLOROPHENYL)CARBONYL)OXY)3METHYL1BENZOFURAN2CARBOXYLATE

356586771

MFCD01992815

ZINC000013941946

ZINC13941946

ethyl4(2chlorobenzoyl)oxy3methyl1benzofuran2carboxylate

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OC(=O)C3=CC=CC=C3Cl)C

InChI=1SC19H15ClO5c132319(22)1711(2)1614(2417)961015(16)2518(21)12745813(12)20h410H3H212H3


BBL000822
Synonyms: ethyl3-methyl-4-[(phenylcarbonyl)oxy]-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)c(ccc2)OC(=O)c1ccccc1

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CCOC(=O)c1oc2c(c1C)c(ccc2)OC(=O)c1ccccc1

ETHYL3METHYL4((PHENYLCARBONYL)OXY)1BENZOFURAN2CARBOXYLATE

MFCD01141555

ZINC000009943129

ZINC09943129

ZINC9943129

2(ETHOXYCARBONYL)3METHYLBENZO(B)FURAN4YLBENZOATE

924976329

ethyl4benzoyloxy3methyl1benzofuran2carboxylate

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OC(=O)C3=CC=CC=C3)C

InChI=1SC19H16O5c132219(21)1712(2)1614(2317)1071115(16)2418(20)138546913h411H3H212H3


BBL000823
Synonyms: ethyl6-bromo-5-methoxy-2-methyl-1-phenyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(OC)c(cc2n(c1C)c1ccccc1)Br

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CCOC(=O)c1c2cc(OC)c(cc2n(c1C)c1ccccc1)Br

ETHYL6BROMO5METHOXY2METHYL1PHENYL1HINDOLE3CARBOXYLATE

ETHYL6BROMO5METHOXY2METHYL1PHENYLINDOLE3CARBOXYLATE

INDOLE3CARBOXYLICACID6BROMO5METHOXY2METHYL1PHENYLETHYLESTER

MFCD00386640

ZINC000000977839

ZINC00977839

ZINC977839

40945742

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)C

InChI=1SC19H18BrNO3c142419(22)1812(2)21(138657913)161115(20)17(233)1014(16)18h511H4H213H3


BBL000824
Synonyms: ethyl4-chloro-3-methyl-5-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-6,7-dihydro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1C)C(=C(CC2)/C=N/NC(=O)c1ccncc1)Cl

more...



CCOC(=O)c1(nH)c2c(c1C)C(=C(CC2)C=NNC(=O)c1ccncc1)Cl

ethyl4chloro3methyl5((E)(2(pyridin4ylcarbonyl)hydrazinylidene)methyl)67dihydro1Hindole2carboxylate

MFCD09222985

ZINC000000846116

333774382


BBL000825
Synonyms: N-(2,3-dihydroxypropyl)-2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: OCC(CNC(=O)c1c(sc2c1CCCC2)NC(=O)c1ccccc1)O

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OCC(CNC(=O)c1c(sc2c1CCCC2)NC(=O)c1ccccc1)O

N(23dihydroxypropyl)2((phenylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxamide

ZINC000000846742

ZINC000000846743

333776399

MFCD00377347

2benzamidoN(23dihydroxypropyl)4567tetrahydro1benzothiophene3carboxamide

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)NCC(CO)O

InChI=1SC19H22N2O4Sc221113(23)102018(25)1614845915(14)2619(16)2117(24)126213712h1367132223H45811H2(H2025)(H2124)


BBL000826
Synonyms: ethyl2-{[(2-chlorophenyl)carbonyl]amino}-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)c1ccccc1Cl

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CCOC(=O)c1c(scc1c1ccccc1)NC(=O)c1ccccc1Cl

ETHYL2(((2CHLOROPHENYL)CARBONYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE

ETHYL2((2CHLOROBENZOYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE

MFCD00266057

ZINC000001986259

ZINC01986259

ZINC1986259

2(2CHLOROBENZOYLAMINO)4PHENYLTHIOPHENE3CARBOXYLICACIDETHYLESTER

331760726

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC=CC=C3Cl

InChI=1SC20H16ClNO3Sc122520(24)1715(138435913)122619(17)2218(23)1410671116(14)21h312H2H21H3(H2223)


BBL000827
Synonyms: ethyl(7Z)-2-(acetylamino)-7-({[(2-chlorophenyl)carbonyl]oxy}imino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC/C/2=N/OC(=O)c1ccccc1Cl

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CCOC(=O)c1c(NC(=O)C)sc2c1CCCC2=NOC(=O)c1ccccc1Cl

ethyl(7Z)2(acetylamino)7((((2chlorophenyl)carbonyl)oxy)imino)4567tetrahydro1benzothiophene3carboxylate

MFCD01106738

ZINC000013941954

331760704


BBL000828
Synonyms: ethyl(7Z)-2-(acetylamino)-7-({[(3-iodophenyl)carbonyl]oxy}imino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC/C/2=N/OC(=O)c1cccc(c1)I

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CCOC(=O)c1c(NC(=O)C)sc2c1CCCC2=NOC(=O)c1cccc(c1)I

ethyl(7Z)2(acetylamino)7((((3iodophenyl)carbonyl)oxy)imino)4567tetrahydro1benzothiophene3carboxylate

MFCD09222987

ZINC000097950064

333780260


BBL000829
Synonyms: ethyl5-acetyl-2-{[(2-chlorophenyl)carbonyl]amino}-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc(c1c1ccccc1)C(=O)C)NC(=O)c1ccccc1Cl

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CCOC(=O)c1c(sc(c1c1ccccc1)C(=O)C)NC(=O)c1ccccc1Cl

ETHYL5ACETYL2(((2CHLOROPHENYL)CARBONYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE

ETHYL5ACETYL2((2CHLOROBENZOYL)AMINO)4PHENYL3THIOPHENECARBOXYLATE

ETHYL5ACETYL2((2CHLOROBENZOYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE

MFCD01241995

ZINC000002075378

ZINC02075378

ZINC2075378

333774406

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C(=O)C)NC(=O)C3=CC=CC=C3Cl

InChI=1SC22H18ClNO4Sc132822(27)1817(1495461014)19(13(2)25)2921(18)2420(26)1511781216(15)23h412H3H212H3(H2426)


BBL000830
Synonyms: ethyl2-(bromomethyl)-5-{[(4-methylphenyl)sulfonyl]oxy}-1-phenyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(CBr)n(c2c1cc(cc2)OS(=O)(=O)c1ccc(cc1)C)c1ccccc1

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CCOC(=O)c1c(CBr)n(c2c1cc(cc2)OS(=O)(=O)c1ccc(cc1)C)c1ccccc1

ETHYL2(BROMOMETHYL)5(((4METHYLPHENYL)SULFONYL)OXY)1PHENYL1HINDOLE3CARBOXYLATE

ETHYL2(BROMOMETHYL)5(4METHYLPHENYL)SULFONYLOXY1PHENYLINDOLE3CARBOXYLATE

88461750

MFCD00316142

ZINC000003144114

ZINC3144114

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4)CBr

InChI=1SC25H22BrNO5Sc133125(28)24211519(3233(2930)2012917(2)101320)111422(21)27(23(24)1626)187546818h415H316H212H3


BBL000831
Synonyms: 5-[(E)-(4-chlorophenyl)diazenyl]quinolin-8-ol
Smiles: Clc1ccc(cc1)/N=N/c1ccc(c2c1cccn2)O

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Clc1ccc(cc1)N=Nc1ccc(c2c1cccn2)O

5((E)(4chlorophenyl)diazenyl)quinolin8ol

897929930

MFCD09910470

ZINC000102034855


BBL000832
Synonyms: 4-methyl-N-(2-oxo-2-phenylethyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NCC(=O)c1ccccc1

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Cc1ccc(cc1)S(=O)(=O)NCC(=O)c1ccccc1

2(((4METHYLPHENYL)SULFONYL)AMINO)1PHENYLETHAN1ONE

2(PTOLUENESULFONAMIDO)ACETOPHENONE

30057922

4METHYLN(2OXO2PHENYLETHYL)BENZENESULFONAMIDE

4METHYLNPHENACYLBENZENESULFONAMIDE

ALPHA(TOSYLAMINO)ACETOPHENONE

MFCD00134348

N(2OXO2PHENYLETHYL)PTOLUENESULFONAMIDE

N(2OXO2PHENYLETHYL)PTOLUENESULFONAMIDE)

ZINC000003163453

ZINC03163453

ZINC3163453

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)C2=CC=CC=C2

InChI=1SC15H15NO3Sc1127914(10812)20(1819)161115(17)135324613h21016H11H21H3


BBL000833
Synonyms: (2Z)-2-(hydroxyimino)-3-phenylpropanoicacid
Smiles: O/N=C(\C(=O)O)/Cc1ccccc1

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ON=C(C(=O)O)Cc1ccccc1

ZINC000004790052

ZINC33940363

(2Z)2(HYDROXYIMINO)3PHENYLPROPANOICACID

(2Z)2HYDROXYIMINO3PHENYLPROPANOICACID

2HYDROXYIMINO3PHENYLPROPANOICACID(HIPP)

99033962

BENZENEPROPANOICACIDA(HYDROXYIMINO)(E)

BENZENEPROPANOICACIDALPHA(HYDROXYIMINO)

C1=CC=C(C=C1)CC(=NO)C(=O)O

InChI=1SC9H9NO3c119(12)8(1013)67421357h1513H6H2(H1112)b108


BBL000834
Synonyms: 3-cyclohexyl-N-(2-oxo-2-phenylethyl)propanamide
Smiles: O=C(NCC(=O)c1ccccc1)CCC1CCCCC1

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O=C(NCC(=O)c1ccccc1)CCC1CCCCC1

ZINC000018193659

ZINC18193659

MFCD09910500

3CYCLOHEXYLN(2OXO2PHENYLETHYL)PROPANAMIDE

519166724

3cyclohexylNphenacylpropanamide

C1CCC(CC1)CCC(=O)NCC(=O)C2=CC=CC=C2

InChI=1SC17H23NO2c1916(1595261015)131817(20)1211147314814h25691014H134781113H2(H1820)


BBL000835
Synonyms: 3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate
Smiles: O=C1c2ccccc2C(=O)c2c1cc(c(c2O)O)S(=O)(=O)[O-]

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O=C1c2ccccc2C(=O)c2c1cc(c(c2O)O)S(=O)(=O)(O)

SODIUM34DIHYDROXY910DIOXO910DIHYDROANTHRACENE2SULFONATE

ZINC000003875857

ZINC03875857

34DIHYDROXY910DIOXO910DIHYDROANTHRACENE2SULFONATE

34DIHYDROXY910DIOXOANTHRACENE2SULFONATE

ALIZARINREDS

12DIHYDROXY3SULFONATOANTHRAQUINONE

1HYDROXY2OXYLATO3SULFONATO910DIOXOANTHRACENE

MFCD00982064

1hydroxy910dioxo3sulfoanthracen2olate

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)(O))S(=O)(=O)O

InChI=1SC14H8O7Sc1511631247(6)12(16)108(11)59(22(1920)21)13(17)14(10)18h151718H(H192021)p1


BBL000836
Synonyms: 2-(4-hydroxyphenyl)-1H-indene-1,3(2H)-dione
Smiles: O=C1C(c2ccc(cc2)O)C(=O)c2c1cccc2

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O=C1C(c2ccc(cc2)O)C(=O)c2c1cccc2

ZINC000100464924

ZINC100464924

MFCD00450735

1217329

2(4HYDROXYPHENYL)13INDANDIONE

2(4HYDROXYPHENYL)1HINDENE13(2H)DIONE

2(4HYDROXYPHENYL)2HYDROCYCLOPENTA(12A)BENZENE13DIONE

2(4HYDROXYPHENYL)INDANE13QUINONE

2(4HYDROXYPHENYL)INDENE13DIONE

C1=CC=C2C(=C1)C(=O)C(C2=O)C3=CC=C(C=C3)O

InChI=1SC15H10O3c1610759(6810)1314(17)11312412(11)15(13)18h181316H


BBL000837
Synonyms: 6-chloro-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one
Smiles: Clc1ccc2c(c1)c1CCNC(=O)c1[nH]2

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Clc1ccc2c(c1)c1CCNC(=O)c1(nH)2

6chloro2349tetrahydro1Hbetacarbolin1one

17952839

6CHLORO1H2H3H4H9HPYRIDO(34B)INDOL1ONE

6CHLORO1TETRAHYDRONORHARMANONE

6CHLORO234TRIHYDROBETACARBOLIN1ONE

PYRIDO(34B)INDOL1(2H)ONE34DIHYDRO6CHLORO

ZINC00194079

ZINC194079

6chloro2349tetrahydropyrido(34b)indol1one

C1CNC(=O)C2=C1C3=C(N2)C=CC(=C3)Cl

InChI=1SC11H9ClN2Oc1261298(56)7341311(15)10(7)149h12514H34H2(H1315)


BBL000838
Synonyms: 6-nitro-2-(prop-2-en-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: C=CCn1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-]

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C=CCn1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O)

189183968

1HBENZ(DE)ISOQUINOLINE13(2H)DIONE6NITRO2(2PROPEN1YL)

2ALLYL6NITRO1HBENZO(DE)ISOQUINOLINE13(2H)DIONE

6NITRO2(PROP2EN1YL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE

6NITRO2PROP2ENYLBENZO(DE)ISOQUINOLINE13DIONE

MFCD00416548

NALLYL4NITRO18NAPHTHALENEDICARBIMIDE

ZINC000004013913

ZINC04013913

ZINC4013913

C=CCN1C(=O)C2=C3C(=C(C=C2)(N+)(=O)(O))C=CC=C3C1=O

InChI=1SC15H10N2O4c1281614(18)10534912(17(20)21)7611(13(9)10)15(16)19h27H18H2


BBL000839
Synonyms: 1-(2-methylbutan-2-yl)-4-(4-nitrophenoxy)benzene
Smiles: CCC(c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-])(C)C

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CCC(c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O))(C)C

1(2METHYLBUTAN2YL)4(4NITROPHENOXY)BENZENE

4(4(11DIMETHYLPROPYL)PHENOXY)1NITROBENZENE

61405514

BENZENE1(11DIMETHYLPROPYL)4(4NITROPHENOXY)

MFCD00187180

ZINC000003122989

ZINC03122989

ZINC3122989

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)(N+)(=O)(O)

InChI=1SC17H19NO3c1417(23)135915(10613)211611714(81216)18(19)20h512H4H213H3


BBL000840
Synonyms: 2,4,6,7-tetramethylpyrrolo[1,2-a]pyrimidine-8-carbonitrile
Smiles: N#Cc1c(C)c(n2c1nc(C)cc2C)C

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N#Cc1c(C)c(n2c1nc(C)cc2C)C

2467tetramethylpyrrolo(12a)pyrimidine8carbonitrile

27078859

ZINC04015334

ZINC4015334

CC1=CC(=NC2=C(C(=C(N12)C)C)C#N)C

InChI=1SC12H13N3c1758(2)1510(4)9(3)11(613)12(15)147h5H14H3


BBL000841
Synonyms:
Smiles: C[Si](C1=CC=CC1[Fe]C1C=CC=C1)(N[Si](C1=CC=CC1[Fe]C1C=CC=C1)(C)C)C

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C(Si)(C1=CC=CC1(Fe)C1C=CC=C1)(N(Si)(C1=CC=CC1(Fe)C1C=CC=C1)(C)C)C

MFCD01107207


BBL000842
Synonyms: 4,5-dihydroxynaphthalene-2,7-disulfonicacid
Smiles: Oc1cc(cc2c1c(O)cc(c2)S(=O)(=O)O)S(=O)(=O)O

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Oc1cc(cc2c1c(O)cc(c2)S(=O)(=O)O)S(=O)(=O)O

ZINC000001532215

ZINC1532215

CHROMOTROPICACID

MFCD00003968

18DIHYDROXYNAPHTHYLENE36DISULFONICACID

27NAPHTHALENEDISULFONICACID45DIHYDROXY

45BIS(OXIDANYL)NAPHTHALENE27DISULFONICACID

45DIHYDROXY27NAPHTHALENEDISULFONICACID

45DIHYDROXYNAPHTHALENE27DISULFONICACID

45DIHYDROXYNAPHTHALENE27DISULPHONICACID

45DIOXONIONAPHTHALENE27DISULFONATE

5808220

C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)(O))(OH2+))(OH2+))S(=O)(=O)(O)

InChI=1SC10H8O8S2c11836(19(1314)15)1527(20(1617)18)49(12)10(5)8h141112H(H131415)(H161718)


BBL000843
Synonyms: 3-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoicacid
Smiles: O=C1N(c2cccc(c2)C(=O)O)C(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl

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O=C1N(c2cccc(c2)C(=O)O)C(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl

3(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)benzoicacid

351998373

ZINC000000630045

ZINC630045

MFCD01046754

3(4567tetrachloro13dioxoisoindol2yl)benzoicacid

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)O

InChI=1SC15H5Cl4NO4c16978(10(17)12(19)11(9)18)14(22)20(13(7)21)63125(46)15(23)24h14H(H2324)


BBL000844
Synonyms: 5-(bromomethyl)-N-phenyl-4,5-dihydro-1,3-thiazol-2-amine
Smiles: BrCC1CN=C(S1)Nc1ccccc1

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BrCC1CN=C(S1)Nc1ccccc1

(5BROMOMETHYL45DIHYDROTHIAZOL2YL)PHENYLAMINE

122504158

5(BROMOMETHYL)NPHENYL45DIHYDRO13THIAZOL2AMINE

C1C(SC(=N1)NC2=CC=CC=C2)CBr

InChI=1SC10H11BrN2Sc116971210(149)138421358h159H67H2(H1213)


BBL000845
Synonyms: propylnitrocarbamate
Smiles: [O-][N+](=O)NC(=O)OCCC

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(O)(N+)(=O)NC(=O)OCCC

354772955

MFCD02068194

PROPYLNITROCARBAMATE

PROPYLNNITROCARBAMATE

ZINC000004507511

ZINC04507511

ZINC4507511

CCCOC(=O)N(N+)(=O)(O)

InChI=1SC4H8N2O4c123104(7)56(8)9h23H21H3(H57)


BBL000846
Synonyms: N-[4,4-dibromo-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-2,2-dimethylpropanamide
Smiles: O=C(C(C)(C)C)NC1=NN(C(=O)C1(Br)Br)c1c(Cl)cc(cc1Cl)Cl

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O=C(C(C)(C)C)NC1=NN(C(=O)C1(Br)Br)c1c(Cl)cc(cc1Cl)Cl

ZINC000002505888

ZINC2505888

439092509

MFCD03037784

N(44DIBROMO5OXO1(246TRICHLOROPHENYL)(2PYRAZOLIN3YL))22DIMETHYLPROPANAMIDE

N(44DIBROMO5OXO1(246TRICHLOROPHENYL)45DIHYDRO1HPYRAZOL3YL)22DIMETHYLPROPANAMIDE

N(44DIBROMO5OXO1(246TRICHLOROPHENYL)45DIHYDRO1HPYRAZOL3YL)PIVALAMIDE

N(44DIBROMO5OXO1(246TRICHLOROPHENYL)PYRAZOL3YL)22DIMETHYLPROPANAMIDE

CC(C)(C)C(=O)NC1=NN(C(=O)C1(Br)Br)C2=C(C=C(C=C2Cl)Cl)Cl

InChI=1SC14H12Br2Cl3N3O2c113(23)11(23)201014(1516)12(24)22(2110)97(18)46(17)58(9)19h45H13H3(H202123)


BBL000847
Synonyms: 1-{[(3,4-dimethoxyphenyl)carbonyl]amino}-5-oxopyrrolidine-3-carboxylicacid
Smiles: COc1cc(ccc1OC)C(=O)NN1CC(CC1=O)C(=O)O

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COc1cc(ccc1OC)C(=O)NN1CC(CC1=O)C(=O)O

MFCD06128442

ZINC000039315674

ZINC000039315675

1(((34DIMETHOXYPHENYL)CARBONYL)AMINO)5OXOPYRROLIDINE3CARBOXYLICACID

1((34DIMETHOXYBENZOYL)AMINO)5OXOPYRROLIDINE3CARBOXYLICACID

894622914

COC1=C(C=C(C=C1)C(=O)NN2CC(CC2=O)C(=O)O)OC

InChI=1SC14H16N2O6c12110438(511(10)222)13(18)151679(14(19)20)612(16)17h359H67H212H3(H1518)(H1920)


BBL000848
Synonyms: 2-(morpholin-4-yl)-4-oxo-4-phenylbutanoicacid
Smiles: O=C(c1ccccc1)CC(C(=O)O)N1CCOCC1

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O=C(c1ccccc1)CC(C(=O)O)N1CCOCC1

ZINC000000343878

ZINC000000343882

MFCD00607961

2(4MORPHOLINYL)4OXO4PHENYLBUTANOICACID

2(MORPHOLIN4YL)4OXO4PHENYLBUTANOICACID

21813616

2MORPHOLIN4YL4OXO4PHENYLBUTANOICACID

2MORPHOLIN4YL4OXO4PHENYLBUTYRICACID

4MORPHOLINEACETICACIDA(2OXO2PHENYLETHYL)

C1COCCN1C(CC(=O)C2=CC=CC=C2)C(=O)O

InChI=1SC14H17NO4c1613(114213511)1012(14(17)18)1568199715h1512H610H2(H1718)


BBL000849
Synonyms: (2Z)-3-chloro-3-(4-nitrophenyl)prop-2-enal
Smiles: O=C/C=C(/c1ccc(cc1)[N+](=O)[O-])\Cl

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O=CC=C(c1ccc(cc1)(N+)(=O)(O))Cl

ZINC000002035738

ZINC02035738

ZINC2035738

CINNAMALDEHYDEBETACHLOROPNITRO

MFCD02905993

(2Z)3CHLORO3(4NITROPHENYL)PROP2ENAL

(Z)3CHLORO3(4NITROPHENYL)ACRYLALDEHYDE

(Z)3CHLORO3(4NITROPHENYL)PROP2ENAL

2888100

2PROPENAL3CHLORO3(4NITROPHENYL)

BETACHLORO4NITROBENZENEPROPENAL

BETACHLOROPNITROCINNAMALDEHYDE

C1=CC(=CC=C1C(=CC=O)Cl)(N+)(=O)(O)

InChI=1SC9H6ClNO3c109(5612)7138(427)11(13)14h16Hb95


BBL000850
Synonyms: 3,3-dibromo-2,3,7,8,9,10,11,11a-octahydro-1H-[1]benzothieno[2,3-b]cyclohepta[e]pyridine-4,12-dione
Smiles: O=C1C2CCCCCC2=Nc2c1c1CCC(C(=O)c1s2)(Br)Br

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O=C1C2CCCCCC2=Nc2c1c1CCC(C(=O)c1s2)(Br)Br

33dibromo23789101111aoctahydro1H(1)benzothieno(23b)cyclohepta(e)pyridine412dione

1241674316

MFCD18185338

ZINC000101313597

ZINC000101313602

C1CCC2C(=NC3=C(C2=O)C4=C(S3)C(=O)C(CC4)(Br)Br)CC1

InChI=1SC16H15Br2NO2Sc1716(18)7691112(20)84213510(8)1915(11)2213(9)14(16)21h8H17H2


BBL000851
Synonyms: ethyl1-ethyl-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F

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CCn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F

ETHYL1ETHYL67DIFLUORO14DIHYDRO4OXOQUINOLINE3CARBOXYLATE

ETHYL1ETHYL67DIFLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLATE

ETHYL1ETHYL67DIFLUORO4OXOHYDROQUINOLINE3CARBOXYLATE

ETHYL1ETHYL67DIFLUORO4OXOQUINOLINE3CARBOXYLATE

100505086

1ETHYL67DIFLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLICACIDETHYLESTER

3QUINOLINECARBOXYLICACID1ETHYL67DIFLUORO14DIHYDRO4OXOETHYLESTER

ZINC00404833

ZINC404833

CCN1C=C(C(=O)C2=CC(=C(C=C21)F)F)C(=O)OCC

InChI=1SC14H13F2NO3c131779(14(19)2042)13(18)8510(15)11(16)612(8)17h57H34H212H3


BBL000852
Synonyms: 6-fluoro-1-methyl-4-oxo-7-(pyrrolidin-1-yl)-1,4-dihydroquinoline-3-carboxylicacid
Smiles: OC(=O)c1cn(C)c2c(c1=O)cc(c(c2)N1CCCC1)F

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OC(=O)c1cn(C)c2c(c1=O)cc(c(c2)N1CCCC1)F

ZINC22510804

1291486628

6FLUORO1METHYL4OXO7(PYRROLIDIN1YL)14DIHYDROQUINOLINE3CARBOXYLICACID

6FLUORO1METHYL4OXO7PYRROLIDIN1YL14DIHYDROQUINOLINE3CARBOXYLICACID

6fluoro1methyl4oxo7pyrrolidin1ylquinoline3carboxylicacid

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCC3)F)C(=O)O

InChI=1SC15H15FN2O3c117810(15(20)21)14(19)9611(16)13(712(9)17)18423518h68H25H21H3(H2021)


BBL000853
Synonyms: 6-fluoro-1-methyl-4-oxo-7-(piperidin-1-yl)-1,4-dihydroquinoline-3-carboxylicacid
Smiles: Fc1cc2c(cc1N1CCCCC1)n(C)cc(c2=O)C(=O)O

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Fc1cc2c(cc1N1CCCCC1)n(C)cc(c2=O)C(=O)O

ZINC21658121

1030120887

6FLUORO1METHYL4OXO7(PIPERIDIN1YL)14DIHYDROQUINOLINE3CARBOXYLICACID

6FLUORO1METHYL4OXO7PIPERIDIN1YL14DIHYDROQUINOLINE3CARBOXYLICACID

6fluoro1methyl4oxo7piperidin1ylquinoline3carboxylicacid

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCC3)F)C(=O)O

InChI=1SC16H17FN2O3c118911(16(21)22)15(20)10712(17)14(813(10)18)195324619h79H26H21H3(H2122)


BBL000854
Synonyms: 6-fluoro-1-methyl-7-(morpholin-4-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: Fc1cc2c(cc1N1CCOCC1)n(C)cc(c2=O)C(=O)O

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Fc1cc2c(cc1N1CCOCC1)n(C)cc(c2=O)C(=O)O

ZINC21658116

6FLUORO1METHYL7(MORPHOLIN4YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID

6FLUORO1METHYL7MORPHOLIN4YL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID

6FLUORO1METHYL7MORPHOLINO4OXO14DIHYDROQUINOLINE3CARBOXYLICACID

70459084

6fluoro1methyl7morpholin4yl4oxoquinoline3carboxylicacid

CN1C=C(C(=O)C2=CC(=C(C=C21)N3CCOCC3)F)C(=O)O

InChI=1SC15H15FN2O4c117810(15(20)21)14(19)9611(16)13(712(9)17)1824225318h68H25H21H3(H2021)


BBL000855
Synonyms: 6-fluoro-1-methyl-7-(4-methylpiperidin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CC1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

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CC1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

1031989259

6FLUORO1METHYL7(4METHYLPIPERIDIN1YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID

ZINC21658119

6fluoro1methyl7(4methylpiperidin1yl)4oxoquinoline3carboxylicacid

CC1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C)F

InChI=1SC17H19FN2O3c1103520(6410)1581411(713(15)18)16(21)12(17(22)23)919(14)2h710H36H212H3(H2223)


BBL000856
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperidin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCC(CC1)C)c(c2)F

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CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCC(CC1)C)c(c2)F

ZINC22511146

1ETHYL6FLUORO7(4METHYLPIPERIDIN1YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID

1ETHYL6FLUORO7(4METHYLPIPERIDINO)14DIHYDRO4OXO3QUINOLINECARBOXYLICACID


BBL000857
Synonyms: 6-fluoro-1-methyl-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CN1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

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CN1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

ZINC21658117

6FLUORO1METHYL7(4METHYLPIPERAZIN1YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID

6FLUORO1METHYL7(4METHYLPIPERAZINYL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID


BBL000858
Synonyms: 7-(4-ethylpiperazin-1-yl)-6-fluoro-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCN1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

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CCN1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

ZINC22510860

7(4ETHYLPIPERAZIN1YL)6FLUORO1METHYL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID


BBL000859
Synonyms: 8-(piperidin-1-ylsulfonyl)[1,2,4]triazolo[4,3-a]pyridine-3(2H)-thione
Smiles: S=c1[nH]nc2n1cccc2S(=O)(=O)N1CCCCC1

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S=c1(nH)nc2n1cccc2S(=O)(=O)N1CCCCC1

ZINC62591944

1291486491

8(PIPERIDIN1YLSULFONYL)(124)TRIAZOLO(43A)PYRIDINE3(2H)THIONE

8piperidin1ylsulfonyl2H(124)triazolo(43a)pyridine3thione

C1CCN(CC1)S(=O)(=O)C2=CC=CN3C2=NNC3=S

InChI=1SC11H14N4O2S2c1619(17146213714)95481510(9)121311(15)18h458H1367H2(H1318)


BBL000860
Synonyms: 8-(piperidin-1-ylsulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Smiles: O=c1[nH]nc2n1cccc2S(=O)(=O)N1CCCCC1

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O=c1(nH)nc2n1cccc2S(=O)(=O)N1CCCCC1

ZINC62591945

1291486822

8(PIPERIDIN1YLSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8piperidin1ylsulfonyl2H(124)triazolo(43a)pyridin3one

C1CCN(CC1)S(=O)(=O)C2=CC=CN3C2=NNC3=O

InChI=1SC11H14N4O3Sc16111312109(54815(10)11)19(1718)146213714h458H1367H2(H1316)


BBL000861
Synonyms: 8-(pyrrolidin-1-ylsulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Smiles: O=c1[nH]nc2n1cccc2S(=O)(=O)N1CCCC1

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O=c1(nH)nc2n1cccc2S(=O)(=O)N1CCCC1

ZINC62591946

1291486957

8(PYRROLIDIN1YLSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8pyrrolidin1ylsulfonyl2H(124)triazolo(43a)pyridin3one

C1CCN(C1)S(=O)(=O)C2=CC=CN3C2=NNC3=O

InChI=1SC10H12N4O3Sc1510121198(43714(9)10)18(1617)13512613h347H1256H2(H1215)


BBL000862
Synonyms: 8-(morpholin-4-ylsulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Smiles: O=c1[nH]nc2n1cccc2S(=O)(=O)N1CCOCC1

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O=c1(nH)nc2n1cccc2S(=O)(=O)N1CCOCC1

ZINC62591947

1291486753

8(MORPHOLIN4YLSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8(MORPHOLINOSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8morpholin4ylsulfonyl2H(124)triazolo(43a)pyridin3one

C1COCCN1S(=O)(=O)C2=CC=CN3C2=NNC3=O

InChI=1SC10H12N4O4Sc1510121198(21314(9)10)19(1617)1346187513h13H47H2(H1215)


BBL000863
Synonyms: 8-(azepan-1-ylsulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Smiles: O=c1[nH]nc2n1cccc2S(=O)(=O)N1CCCCCC1

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O=c1(nH)nc2n1cccc2S(=O)(=O)N1CCCCCC1

ZINC62591948

1291486980

8(AZEPAN1YLSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8(azepan1ylsulfonyl)2H(124)triazolo(43a)pyridin3one

C1CCCN(CC1)S(=O)(=O)C2=CC=CN3C2=NNC3=O

InChI=1SC12H16N4O3Sc171214131110(65916(11)12)20(1819)1573124815h569H1478H2(H1417)


BBL000864
Synonyms: 8-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Smiles: O=c1[nH]nc2n1cccc2S(=O)(=O)N1CCc2c(C1)cccc2

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O=c1(nH)nc2n1cccc2S(=O)(=O)N1CCc2c(C1)cccc2

ZINC62591950

1291486866

8(34DIHYDROISOQUINOLIN2(1H)YLSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)O

8(34DIHYDROISOQUINOLIN2(1H)YLSULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8(34dihydro1Hisoquinolin2ylsulfonyl)2H(124)triazolo(43a)pyridin3one

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CN4C3=NNC4=O

InChI=1SC15H14N4O3Sc201517161413(63819(14)15)23(2122)189711412512(11)1018h168H7910H2(H1720)


BBL000865
Synonyms: 8-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cccn2c1n[nH]c2=O

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Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cccn2c1n(nH)c2=O

ZINC62591952

1291486968

8((4(4FLUOROPHENYL)PIPERAZIN1YL)SULFONYL)(124)TRIAZOLO(43A)PYRIDIN3(2H)ONE

8((4(4FLUOROPHENYL)PIPERAZIN1YL)SULFONYL)2H3H(124)TRIAZOLO(43A)PYRIDIN3ONE

8(4(4fluorophenyl)piperazin1yl)sulfonyl2H(124)triazolo(43a)pyridin3one

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CN4C3=NNC4=O

InChI=1SC16H16FN5O3Sc17123513(6412)2081021(11920)26(2425)142172215(14)181916(22)23h17H811H2(H1923)


BBL000866
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl){1-[3-(pyrrolidin-1-ylsulfonyl)pyridin-2-yl]piperidin-4-yl}methanone
Smiles: Cc1nn(c(c1)C)C(=O)C1CCN(CC1)c1ncccc1S(=O)(=O)N1CCCC1

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Cc1nn(c(c1)C)C(=O)C1CCN(CC1)c1ncccc1S(=O)(=O)N1CCCC1

ZINC62591954

(35DIMETHYL1HPYRAZOL1YL)(1(3(PYRROLIDIN1YLSULFONYL)PYRIDIN2YL)PIPERIDIN4YL)METHANONE


BBL000867
Synonyms: 1-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Cc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O

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Cc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O

ZINC1394411

1(4METHYLPHENYL)4OXO14DIHYDRO3PYRIDAZINECARBOXYLICACID

1(4METHYLPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1(4METHYLPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID

1(4METHYLPHENYL)4OXOPYRIDAZINE3CARBOXYLICACID

478063579

CC1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O

InChI=1SC12H10N2O3c18249(538)147610(15)11(1314)12(16)17h27H1H3(H1617)


BBL000868
Synonyms: 3-(3,4-dimethylphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: OC(=O)c1nn(c2ccc(c(c2)C)C)c(=O)c2c1cccc2

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OC(=O)c1nn(c2ccc(c(c2)C)C)c(=O)c2c1cccc2

ZINC6923910

3(34DIMETHYLPHENYL)4KETOPHTHALAZINE1CARBOXYLICACID

3(34DIMETHYLPHENYL)4OXIDANYLIDENEPHTHALAZINE1CARBOXYLICACID

3(34DIMETHYLPHENYL)4OXO1PHTHALAZINECARBOXYLICACID

3(34DIMETHYLPHENYL)4OXO34DIHYDRO1PHTHALAZINECARBOXYLICACID

3(34DIMETHYLPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(34DIMETHYLPHENYL)4OXOPHTHALAZINE1CARBOXYLICACID

861212637

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O)C

InChI=1SC17H14N2O3c1107812(911(10)2)1916(20)14643513(14)15(1819)17(21)22h39H12H3(H2122)


BBL000869
Synonyms: 1-(3,4-dimethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: OC(=O)c1nn(ccc1=O)c1ccc(c(c1)C)C

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OC(=O)c1nn(ccc1=O)c1ccc(c(c1)C)C

ZINC31978814

1(34DIMETHYLPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

937690976

1(34dimethylphenyl)4oxopyridazine3carboxylicacid

CC1=C(C=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O)C

InChI=1SC13H12N2O3c183410(79(8)2)156511(16)12(1415)13(17)18h37H12H3(H1718)


BBL000870
Synonyms: 1-(3,5-dimethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Cc1cc(C)cc(c1)n1ccc(=O)c(n1)C(=O)O

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Cc1cc(C)cc(c1)n1ccc(=O)c(n1)C(=O)O

ZINC31977347

1(35DIMETHYLPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

937670774

1(35dimethylphenyl)4oxopyridazine3carboxylicacid

CC1=CC(=CC(=C1)N2C=CC(=O)C(=N2)C(=O)O)C

InChI=1SC13H12N2O3c1859(2)710(68)154311(16)12(1415)13(17)18h37H12H3(H1718)


BBL000871
Synonyms: 1-(3,4-dimethoxyphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: COc1cc(ccc1OC)n1ccc(=O)c(n1)C(=O)O

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COc1cc(ccc1OC)n1ccc(=O)c(n1)C(=O)O

ZINC62591956

1(34DIMETHOXYPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1291486979

1(34dimethoxyphenyl)4oxopyridazine3carboxylicacid

COC1=C(C=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O)OC

InChI=1SC13H12N2O5c11910438(711(10)202)15659(16)12(1415)13(17)18h37H12H3(H1718)


BBL000872
Synonyms: 1-[3-(methylsulfanyl)phenyl]-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: CSc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

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CSc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

ZINC62591957

1(3(METHYLSULFANYL)PHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1(3(METHYLTHIO)PHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1291486548

1(3methylsulfanylphenyl)4oxopyridazine3carboxylicacid

CSC1=CC=CC(=C1)N2C=CC(=O)C(=N2)C(=O)O

InChI=1SC12H10N2O3Sc11894238(79)146510(15)11(1314)12(16)17h27H1H3(H1617)


BBL000873
Synonyms: 1-(3-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Fc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

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Fc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

ZINC62152006

1(3FLUOROPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1291486991

1(3fluorophenyl)4oxopyridazine3carboxylicacid

C1=CC(=CC(=C1)F)N2C=CC(=O)C(=N2)C(=O)O

InChI=1SC11H7FN2O3c1272138(67)14549(15)10(1314)11(16)17h16H(H1617)


BBL000874
Synonyms: 1-(3,4-difluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: OC(=O)c1nn(ccc1=O)c1ccc(c(c1)F)F

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OC(=O)c1nn(ccc1=O)c1ccc(c(c1)F)F

ZINC62591958

1(34DIFLUOROPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1291487132

3PYRIDAZINECARBOXYLICACID1(34DIFLUOROPHENYL)14DIHYDRO4OXO

1(34difluorophenyl)4oxopyridazine3carboxylicacid

C1=CC(=C(C=C1N2C=CC(=O)C(=N2)C(=O)O)F)F

InChI=1SC11H6F2N2O3c127216(58(7)13)15439(16)10(1415)11(17)18h15H(H1718)


BBL000875
Synonyms: 1-(3-bromophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Brc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

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Brc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

ZINC53994336

1(3BROMOPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID

1(3BROMOPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID

1283709421

3PYRIDAZINECARBOXYLICACID1(3BROMOPHENYL)14DIHYDRO4OXO

1(3bromophenyl)4oxopyridazine3carboxylicacid

C1=CC(=CC(=C1)Br)N2C=CC(=O)C(=N2)C(=O)O

InChI=1SC11H7BrN2O3c1272138(67)14549(15)10(1314)11(16)17h16H(H1617)


BBL000876
Synonyms: 3-(4-ethylphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: CCc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

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CCc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

ZINC62591959

1291486902

3(4ETHYLPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(4ethylphenyl)4oxophthalazine1carboxylicacid

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI=1SC17H14N2O3c12117912(10811)1916(20)14643513(14)15(1819)17(21)22h310H2H21H3(H2122)


BBL000877
Synonyms: 3-[3-(methylsulfanyl)phenyl]-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: CSc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

more...



CSc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

ZINC62591960

1291487143

3(3(METHYLSULFANYL)PHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

3(3methylsulfanylphenyl)4oxophthalazine1carboxylicacid

CSC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI=1SC16H12N2O3Sc1221164510(911)1815(19)13832712(13)14(1718)16(20)21h29H1H3(H2021)


BBL000878
Synonyms: 3-(3-bromophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Brc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Brc1cccc(c1)n1nc(C(=O)O)c2c(c1=O)cccc2

1291486844

3(3BROMOPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

ZINC62591961

3(3bromophenyl)4oxophthalazine1carboxylicacid

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC(=CC=C3)Br)C(=O)O

InChI=1SC15H9BrN2O3c16943510(89)1814(19)12721611(12)13(1718)15(20)21h18H(H2021)


BBL000879
Synonyms: 3-(4-bromophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: Brc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

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Brc1ccc(cc1)n1nc(C(=O)O)c2c(c1=O)cccc2

1291487096

3(4BROMOPHENYL)4OXO34DIHYDROPHTHALAZINE1CARBOXYLICACID

ZINC62591962

3(4bromophenyl)4oxophthalazine1carboxylicacid

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)Br)C(=O)O

InChI=1SC15H9BrN2O3c1695710(869)1814(19)12421311(12)13(1718)15(20)21h18H(H2021)


BBL000880
Synonyms: 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: CCc1ccc(cc1)n1cc(C(=O)O)c2c(c1=O)cccc2

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CCc1ccc(cc1)n1cc(C(=O)O)c2c(c1=O)cccc2

ZINC62591963

2(4ETHYLPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID


BBL000881
Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methyl-N-(4-methylphenyl)thiophene-3-sulfonamide
Smiles: Cc1ccc(cc1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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Cc1ccc(cc1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

ZINC16843446

1172932250

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLN(4METHYLPHENYL)THIOPHENE3SULFONAMIDE

2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLN(PTOLYL)THIOPHENE3SULFONAMIDE

2(35dimethylpyrazole1carbonyl)NmethylN(4methylphenyl)thiophene3sulfonamide

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C

InChI=1SC18H19N3O3S2c1125715(8612)20(4)26(2324)169102517(16)18(22)2114(3)1113(2)1921h511H14H3


BBL000882
Synonyms: N-(3,5-dimethylphenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: Cc1cc(C)cc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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Cc1cc(C)cc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

1207022158

2(35DIMETHYL1HPYRAZOLE1CARBONYL)N(35DIMETHYLPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(35DIMETHYLPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC38654840

N(35dimethylphenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=CC(=C1)N(C)S(=O)(=O)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C)C

InChI=1SC19H21N3O3S2c112813(2)1016(912)21(5)27(2425)17672618(17)19(23)2215(4)1114(3)2022h611H15H3


BBL000883
Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-(4-ethylphenyl)-N-methylthiophene-3-sulfonamide
Smiles: CCc1ccc(cc1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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CCc1ccc(cc1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

ZINC35462634

1189907401

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)N(4ETHYLPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35dimethylpyrazole1carbonyl)N(4ethylphenyl)Nmethylthiophene3sulfonamide

CCC1=CC=C(C=C1)N(C)S(=O)(=O)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C

InChI=1SC19H21N3O3S2c15156816(9715)21(4)27(2425)1710112618(17)19(23)2214(3)1213(2)2022h612H5H214H3


BBL000884
Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methyl-N-[4-(propan-2-yl)phenyl]thiophene-3-sulfonamide
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc(cc1)C(C)C)C

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc(cc1)C(C)C)C

ZINC62591964

1291486515

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)N(4ISOPROPYLPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLN(4(PROPAN2YL)PHENYL)THIOPHENE3SULFONAMIDE

2(35dimethylpyrazole1carbonyl)NmethylN(4propan2ylphenyl)thiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC=C(C=C3)C(C)C)C

InChI=1SC20H23N3O3S2c113(2)166817(9716)22(5)28(2526)1810112719(18)20(24)2315(4)1214(3)2123h613H15H3


BBL000885
Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-(3-methoxyphenyl)-N-methylthiophene-3-sulfonamide
Smiles: COc1cccc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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COc1cccc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

ZINC35462679

1189986433

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)N(3METHOXYPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35DIMETHYL1HPYRAZOLE1CARBONYL)N(3METHOXYPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35dimethylpyrazole1carbonyl)N(3methoxyphenyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC(=CC=C3)OC)C

InChI=1SC18H19N3O4S2c1121013(2)21(1912)18(22)1716(892617)27(2324)20(3)1465715(1114)254h511H14H3


BBL000886
Synonyms: N-(3,4-dimethoxyphenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: COc1cc(ccc1OC)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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COc1cc(ccc1OC)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

1207059060

N(34DIMETHOXYPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(34DIMETHOXYPHENYL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC38654848

N(34dimethoxyphenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC(=C(C=C3)OC)OC)C

InChI=1SC19H21N3O5S2c1121013(2)22(2012)19(23)1817(892818)29(2425)21(3)146715(264)16(1114)275h611H15H3


BBL000887
Synonyms: N-(3,5-dimethoxyphenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: COc1cc(OC)cc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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COc1cc(OC)cc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

1170794747

N(35DIMETHOXYPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(35DIMETHOXYPHENYL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC23126940

N(35dimethoxyphenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC(=CC(=C3)OC)OC)C

InChI=1SC19H21N3O5S2c112813(2)22(2012)19(23)1817(672818)29(2425)21(3)14915(264)1116(1014)275h611H15H3


BBL000888
Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-(4-ethoxyphenyl)-N-methylthiophene-3-sulfonamide
Smiles: CCOc1ccc(cc1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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CCOc1ccc(cc1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

ZINC38654844

1207038605

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)N(4ETHOXYPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35DIMETHYL1HPYRAZOLE1CARBONYL)N(4ETHOXYPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35dimethylpyrazole1carbonyl)N(4ethoxyphenyl)Nmethylthiophene3sulfonamide

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C

InChI=1SC19H21N3O4S2c1526168615(7916)21(4)28(2425)1710112718(17)19(23)2214(3)1213(2)2022h612H5H214H3


BBL000889
Synonyms: N-(1,3-benzodioxol-5-yl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc2c(c1)OCO2)C

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc2c(c1)OCO2)C

1172992878

N(13BENZODIOXOL5YL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(BENZO(D)(13)DIOXOL5YL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC23126939

N(13benzodioxol5yl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC4=C(C=C3)OCO4)C

InChI=1SC18H17N3O5S2c111812(2)21(1911)18(22)1716(672717)28(2324)20(3)13451415(913)26102514h49H10H213H3


BBL000890
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc2c(c1)OCCO2)C

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc2c(c1)OCCO2)C

1172700218

N(23DIHYDRO14BENZODIOXIN6YL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(23DIHYDROBENZO(B)(14)DIOXIN6YL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC23126944

N(23dihydro14benzodioxin6yl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC4=C(C=C3)OCCO4)C

InChI=1SC19H19N3O5S2c1121013(2)22(2012)19(23)1817(692818)29(2425)21(3)14451516(1114)27872615h46911H78H213H3


BBL000891
Synonyms: N-(3-chlorophenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: Clc1cccc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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Clc1cccc(c1)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

1291486582

N(3CHLOROPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC62591966

N(3chlorophenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC(=CC=C3)Cl)C

InChI=1SC17H16ClN3O3S2c111912(2)21(1911)17(22)1615(782516)26(2324)20(3)1464513(18)1014h410H13H3


BBL000892
Synonyms: N-(3,4-difluorophenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc(c(c1)F)F)C

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N(c1ccc(c(c1)F)F)C

1171382709

N(34DIFLUOROPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(34DIFLUOROPHENYL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC23126943

N(34difluorophenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC(=C(C=C3)F)F)C

InChI=1SC17H15F2N3O3S2c110811(2)22(2010)17(23)1615(672616)27(2425)21(3)124513(18)14(19)912h49H13H3


BBL000893
Synonyms: 2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-(3-fluoro-4-methylphenyl)-N-methylthiophene-3-sulfonamide
Smiles: Cc1cc(n(n1)C(=O)c1sccc1S(=O)(=O)N(c1ccc(c(c1)F)C)C)C

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Cc1cc(n(n1)C(=O)c1sccc1S(=O)(=O)N(c1ccc(c(c1)F)C)C)C

ZINC35462683

1189731790

2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)N(3FLUORO4METHYLPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35DIMETHYL1HPYRAZOLE1CARBONYL)N(3FLUORO4METHYLPHENYL)NMETHYLTHIOPHENE3SULFONAMIDE

2(35dimethylpyrazole1carbonyl)N(3fluoro4methylphenyl)Nmethylthiophene3sulfonamide

CC1=C(C=C(C=C1)N(C)S(=O)(=O)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C)F

InChI=1SC18H18FN3O3S2c1115614(1015(11)19)21(4)27(2425)16782617(16)18(23)2213(3)912(2)2022h510H14H3


BBL000894
Synonyms: N-(3-chloro-4-methylphenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: Cc1cc(n(n1)C(=O)c1sccc1S(=O)(=O)N(c1ccc(c(c1)Cl)C)C)C

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Cc1cc(n(n1)C(=O)c1sccc1S(=O)(=O)N(c1ccc(c(c1)Cl)C)C)C

1189958960

N(3CHLORO4METHYLPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(3CHLORO4METHYLPHENYL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC35462686

N(3chloro4methylphenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=C(C=C(C=C1)N(C)S(=O)(=O)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C)Cl

InChI=1SC18H18ClN3O3S2c1115614(1015(11)19)21(4)27(2425)16782617(16)18(23)2213(3)912(2)2022h510H14H3


BBL000895
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-N-methylthiophene-3-sulfonamide
Smiles: COc1ccc(cc1Cl)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

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COc1ccc(cc1Cl)N(S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C)C

1207007462

N(3CHLORO4METHOXYPHENYL)2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

N(3CHLORO4METHOXYPHENYL)2(35DIMETHYL1HPYRAZOLE1CARBONYL)NMETHYLTHIOPHENE3SULFONAMIDE

ZINC38654852

N(3chloro4methoxyphenyl)2(35dimethylpyrazole1carbonyl)Nmethylthiophene3sulfonamide

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N(C)C3=CC(=C(C=C3)OC)Cl)C

InChI=1SC18H18ClN3O4S2c111912(2)22(2011)18(23)1716(782717)28(2425)21(3)135615(264)14(19)1013h510H14H3


BBL000896
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl){3-[(4-phenylpiperazin-1-yl)sulfonyl]thiophen-2-yl}methanone
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1ccccc1

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1ccccc1

ZINC16843462

(35DIMETHYL1HPYRAZOL1YL)(3((4PHENYLPIPERAZIN1YL)SULFONYL)THIOPHEN2YL)METHANONE

1((2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)SULFONYL)4PHENYLPIPERAZINE

1171238688

(35dimethylpyrazol1yl)(3(4phenylpiperazin1yl)sulfonylthiophen2yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI=1SC20H22N4O3S2c1151416(2)24(2115)20(25)1918(8132819)29(2627)2311922(101223)176435717h381314H912H212H3


BBL000897
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl)(3-{[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methanone
Smiles: COc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

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COc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

ZINC62591967

(35DIMETHYL1HPYRAZOL1YL)(3((4(3METHOXYPHENYL)PIPERAZIN1YL)SULFONYL)THIOPHEN2YL)METHANONE

1((2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)SULFONYL)4(3METHOXYPHENYL)PIPERAZINE

1291487007

(35dimethylpyrazol1yl)(3(4(3methoxyphenyl)piperazin1yl)sulfonylthiophen2yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC)C

InChI=1SC21H24N4O4S2c1151316(2)25(2215)21(26)2019(7123020)31(2728)2410823(91124)1754618(1417)293h471214H811H213H3


BBL000898
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl)(3-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methanone
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1ccccc1F

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1ccccc1F

ZINC16843452

(35DIMETHYL1HPYRAZOL1YL)(3((4(2FLUOROPHENYL)PIPERAZIN1YL)SULFONYL)THIOPHEN2YL)METHANONE

1170466633

(35dimethylpyrazol1yl)(3(4(2fluorophenyl)piperazin1yl)sulfonylthiophen2yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F)C

InChI=1SC20H21FN4O3S2c1141315(2)25(2214)20(26)1918(7122919)30(2728)2410823(91124)17643516(17)21h371213H811H212H3


BBL000899
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl)(3-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

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Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

ZINC23126468

(35DIMETHYL1HPYRAZOL1YL)(3((4(4FLUOROPHENYL)PIPERAZIN1YL)SULFONYL)THIOPHEN2YL)METHANONE

1((2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)SULFONYL)4(4FLUOROPHENYL)PIPERAZINE

1171980554

(35dimethylpyrazol1yl)(3(4(4fluorophenyl)piperazin1yl)sulfonylthiophen2yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C

InChI=1SC20H21FN4O3S2c1141315(2)25(2214)20(26)1918(7122919)30(2728)2410823(91124)175316(21)4617h371213H811H212H3


BBL000900
Synonyms: (3-{[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1ccccc1Cl

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Cc1nn(c(c1)C)C(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1ccccc1Cl

ZINC62591968

(3((4(2CHLOROPHENYL)PIPERAZIN1YL)SULFONYL)THIOPHEN2YL)(35DIMETHYL1HPYRAZOL1YL)METHANONE

1(2CHLOROPHENYL)4((2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)SULFONYL)PIPERAZINE

1291487018

(3(4(2chlorophenyl)piperazin1yl)sulfonylthiophen2yl)(35dimethylpyrazol1yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4Cl)C

InChI=1SC20H21ClN4O3S2c1141315(2)25(2214)20(26)1918(7122919)30(2728)2410823(91124)17643516(17)21h371213H811H212H3


BBL000901
Synonyms: (3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone
Smiles: Clc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

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Clc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

ZINC35462689

(3((4(3CHLOROPHENYL)PIPERAZIN1YL)SULFONYL)THIOPHEN2YL)(35DIMETHYL1HPYRAZOL1YL)METHANONE

1(3CHLOROPHENYL)4((2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)SULFONYL)PIPERAZINE

1207007622

(3(4(3chlorophenyl)piperazin1yl)sulfonylthiophen2yl)(35dimethylpyrazol1yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C

InChI=1SC20H21ClN4O3S2c1141215(2)25(2214)20(26)1918(6112919)30(2728)249723(81024)1753416(21)1317h361113H710H212H3


BBL000902
Synonyms: (3-{[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl}thiophen-2-yl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone
Smiles: Clc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

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Clc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)n1nc(cc1C)C

ZINC16843455

(3((4(4CHLOROPHENYL)PIPERAZIN1YL)SULFONYL)THIOPHEN2YL)(35DIMETHYL1HPYRAZOL1YL)METHANONE

1(4CHLOROPHENYL)4((2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)SULFONYL)PIPERAZINE

1171812171

(3(4(4chlorophenyl)piperazin1yl)sulfonylthiophen2yl)(35dimethylpyrazol1yl)methanone

CC1=CC(=NN1C(=O)C2=C(C=CS2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)Cl)C

InChI=1SC20H21ClN4O3S2c1141315(2)25(2214)20(26)1918(7122919)30(2728)2410823(91124)175316(21)4617h371213H811H212H3


BBL000903
Synonyms: 3-[(phenylsulfonyl)amino]thiophene-2-carboxylicacid
Smiles: OC(=O)c1sccc1NS(=O)(=O)c1ccccc1

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OC(=O)c1sccc1NS(=O)(=O)c1ccccc1

ZINC38137743

3((PHENYLSULFONYL)AMINO)THIOPHENE2CARBOXYLICACID

3BENZENESULFONYLAMINOTHIOPHENE2CARBOXYLICACID

409364789

3(benzenesulfonamido)thiophene2carboxylicacid

C1=CC=C(C=C1)S(=O)(=O)NC2=C(SC=C2)C(=O)O

InChI=1SC11H9NO4S2c1311(14)109(671710)1218(1516)8421358h1712H(H1314)


BBL000904
Synonyms: 3-{[(2,4,6-trimethylphenyl)sulfonyl]amino}thiophene-2-carboxylicacid
Smiles: Cc1cc(C)c(c(c1)C)S(=O)(=O)Nc1ccsc1C(=O)O

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Cc1cc(C)c(c(c1)C)S(=O)(=O)Nc1ccsc1C(=O)O

ZINC35306400

1153238915

3(((246TRIMETHYLPHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLICACID

3((MESITYLSULFONYL)AMINO)THIOPHENE2CARBOXYLICACID

3(246TRIMETHYLBENZENESULFONAMIDO)THIOPHENE2CARBOXYLICACID

3((246trimethylphenyl)sulfonylamino)thiophene2carboxylicacid

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=C(SC=C2)C(=O)O)C

InChI=1SC14H15NO4S2c1869(2)13(10(3)78)21(1819)1511452012(11)14(16)17h4715H13H3(H1617)


BBL000905
Synonyms: 3-{[(4-propylphenyl)sulfonyl]amino}thiophene-2-carboxylicacid
Smiles: CCCc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O

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CCCc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O

ZINC35306387

1153238879

3(((4PROPYLPHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLICACID

3((4propylphenyl)sulfonylamino)thiophene2carboxylicacid

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(SC=C2)C(=O)O

InChI=1SC14H15NO4S2c123104611(7510)21(1819)1512892013(12)14(16)17h4915H23H21H3(H1617)


BBL000906
Synonyms: 3-{[(4-fluorophenyl)sulfonyl]amino}thiophene-2-carboxylicacid
Smiles: Fc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O

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Fc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O

ZINC38137734

3(((4FLUOROPHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLICACID

926227921

3((4fluorophenyl)sulfonylamino)thiophene2carboxylicacid

C1=CC(=CC=C1F)S(=O)(=O)NC2=C(SC=C2)C(=O)O

InChI=1SC11H8FNO4S2c127138(427)19(1617)139561810(9)11(14)15h1613H(H1415)


BBL000907
Synonyms: 3-{[(4-ethylphenyl)sulfonyl](methyl)amino}thiophene-2-carboxylicacid
Smiles: CCc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)O)C

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CCc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)O)C

ZINC62591970

1291486639

3(((4ETHYLPHENYL)SULFONYL)(METHYL)AMINO)THIOPHENE2CARBOXYLICACID

3((4ethylphenyl)sulfonylmethylamino)thiophene2carboxylicacid

CCC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)O

InChI=1SC14H15NO4S2c13104611(7510)21(1819)15(2)12892013(12)14(16)17h49H3H212H3(H1617)


BBL000908
Synonyms: 3-{[(4-fluorophenyl)sulfonyl](methyl)amino}thiophene-2-carboxylicacid
Smiles: Fc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)O)C

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Fc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)O)C

ZINC62591971

1291486617

3(((4FLUOROPHENYL)SULFONYL)(METHYL)AMINO)THIOPHENE2CARBOXYLICACID

3(NMETHYL4FLUOROBENZENESULFONAMIDO)THIOPHENE2CARBOXYLICACID

3((4fluorophenyl)sulfonylmethylamino)thiophene2carboxylicacid

CN(C1=C(SC=C1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)F

InChI=1SC12H10FNO4S2c114(10671911(10)12(15)16)20(1718)9428(13)359h27H1H3(H1516)


BBL000909
Synonyms: 3-{[(4-bromophenyl)sulfonyl](methyl)amino}thiophene-2-carboxylicacid
Smiles: Brc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)O)C

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Brc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)O)C

1291486571

3(((4BROMOPHENYL)SULFONYL)(METHYL)AMINO)THIOPHENE2CARBOXYLICACID

ZINC62591972

3((4bromophenyl)sulfonylmethylamino)thiophene2carboxylicacid

CN(C1=C(SC=C1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)Br

InChI=1SC12H10BrNO4S2c114(10671911(10)12(15)16)20(1718)9428(13)359h27H1H3(H1516)


BBL000910
Synonyms: 3-methyl-7-phenyl-2-thioxo-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Smiles: Cn1c(=S)[nH]c2c(c1=O)scc2c1ccccc1

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Cn1c(=S)(nH)c2c(c1=O)scc2c1ccccc1

ZINC15828783

1019137984

3METHYL7PHENYL2THIOXO23DIHYDROTHIENO(32D)PYRIMIDIN4(1H)ONE

3methyl7phenyl2sulfanylidene1Hthieno(32d)pyrimidin4one

CN1C(=O)C2=C(C(=CS2)C3=CC=CC=C3)NC1=S

InChI=1SC13H10N2OS2c11512(16)1110(1413(15)17)9(71811)8532468h27H1H3(H1417)


BBL000911
Synonyms: 3-ethyl-7-phenyl-2-thioxo-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Smiles: CCn1c(=S)[nH]c2c(c1=O)scc2c1ccccc1

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CCn1c(=S)(nH)c2c(c1=O)scc2c1ccccc1

ZINC15829084

1019151951

3ETHYL7PHENYL2THIOXO23DIHYDROTHIENO(32D)PYRIMIDIN4(1H)ONE

3ethyl7phenyl2sulfanylidene1Hthieno(32d)pyrimidin4one

CCN1C(=O)C2=C(C(=CS2)C3=CC=CC=C3)NC1=S

InChI=1SC14H12N2OS2c121613(17)1211(1514(16)18)10(81912)9643579h38H2H21H3(H1518)


BBL000912
Synonyms: 3-methyl-7-(4-methylphenyl)-2-thioxo-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Smiles: Cc1ccc(cc1)c1csc2c1[nH]c(=S)n(c2=O)C

more...



Cc1ccc(cc1)c1csc2c1(nH)c(=S)n(c2=O)C

ZINC62591974

1291486764

3METHYL7(4METHYLPHENYL)2THIOXO23DIHYDROTHIENO(32D)PYRIMIDIN4(1H)ONE

3methyl7(4methylphenyl)2sulfanylidene1Hthieno(32d)pyrimidin4one

CC1=CC=C(C=C1)C2=CSC3=C2NC(=S)N(C3=O)C

InChI=1SC14H12N2OS2c18359(648)107191211(10)1514(18)16(2)13(12)17h37H12H3(H1518)


BBL000913
Synonyms: 3-ethyl-7-(4-methylphenyl)-2-thioxo-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Smiles: CCn1c(=S)[nH]c2c(c1=O)scc2c1ccc(cc1)C

more...



CCn1c(=S)(nH)c2c(c1=O)scc2c1ccc(cc1)C

ZINC62591975

1291486913

3ETHYL7(4METHYLPHENYL)2THIOXO23DIHYDROTHIENO(32D)PYRIMIDIN4(1H)ONE

3ethyl7(4methylphenyl)2sulfanylidene1Hthieno(32d)pyrimidin4one

CCN1C(=O)C2=C(C(=CS2)C3=CC=C(C=C3)C)NC1=S

InChI=1SC15H14N2OS2c131714(18)1312(1615(17)19)11(82013)10649(2)5710h48H3H212H3(H1619)


BBL000914
Synonyms: 7-(2-methylphenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccccc1C

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CSc1nc2c(csc2c(=O)(nH)1)c1ccccc1C

ZINC62591977

1291486786

7(2METHYLPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2METHYLPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2methylphenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CC1=CC=CC=C1C2=CSC3=C2NC(=NC3=O)SC

InChI=1SC14H12N2OS2c1853469(8)107191211(10)1514(182)1613(12)17h37H12H3(H151617)


BBL000915
Synonyms: 7-(4-methylphenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccc(cc1)C

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CSc1nc2c(csc2c(=O)(nH)1)c1ccc(cc1)C

ZINC21658125

1031969488

2(METHYLTHIO)7(PTOLYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4METHYLPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4methylphenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CC1=CC=C(C=C1)C2=CSC3=C2NC(=NC3=O)SC

InChI=1SC14H12N2OS2c18359(648)107191211(10)1514(182)1613(12)17h37H12H3(H151617)


BBL000916
Synonyms: 7-(4-methoxyphenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)c1csc2c1nc(SC)[nH]c2=O

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COc1ccc(cc1)c1csc2c1nc(SC)(nH)c2=O

ZINC62591979

1291487029

7(4METHOXYPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4METHOXYPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4methoxyphenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

COC1=CC=C(C=C1)C2=CSC3=C2NC(=NC3=O)SC

InChI=1SC14H12N2O2S2c1189538(469)107201211(10)1514(192)1613(12)17h37H12H3(H151617)


BBL000917
Synonyms: 7-(3,4-dimethoxyphenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: COc1cc(ccc1OC)c1csc2c1nc(SC)[nH]c2=O

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COc1cc(ccc1OC)c1csc2c1nc(SC)(nH)c2=O

ZINC62591980

1291487109

7(34DIMETHOXYPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34DIMETHOXYPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34dimethoxyphenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

COC1=C(C=C(C=C1)C2=CSC3=C2NC(=NC3=O)SC)OC

InChI=1SC15H14N2O3S2c11910548(611(10)202)97221312(9)1615(213)1714(13)18h47H13H3(H161718)


BBL000918
Synonyms: 7-(3,4-diethoxyphenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CCOc1cc(ccc1OCC)c1csc2c1nc(SC)[nH]c2=O

more...



CCOc1cc(ccc1OCC)c1csc2c1nc(SC)(nH)c2=O

ZINC62591981

1291486877

7(34DIETHOXYPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34DIETHOXYPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34diethoxyphenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CCOC1=C(C=C(C=C1)C2=CSC3=C2NC(=NC3=O)SC)OCC

InChI=1SC17H18N2O3S2c1421127610(813(12)2252)119241514(11)1817(233)1916(15)20h69H45H213H3(H181920)


BBL000919
Synonyms: 7-(2-fluorophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccccc1F

more...



CSc1nc2c(csc2c(=O)(nH)1)c1ccccc1F

ZINC62591982

1291486855

7(2FLUOROPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2FLUOROPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2fluorophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC=CC=C3F

InChI=1SC13H9FN2OS2c1181315108(61911(10)12(17)1613)742359(7)14h26H1H3(H151617)


BBL000920
Synonyms: 7-(3-fluorophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1cccc(c1)F

more...



CSc1nc2c(csc2c(=O)(nH)1)c1cccc(c1)F

ZINC62591983

1291486606

7(3FLUOROPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3FLUOROPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3fluorophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC(=CC=C3)F

InChI=1SC13H9FN2OS2c1181315109(61911(10)12(17)1613)73248(14)57h26H1H3(H151617)


BBL000921
Synonyms: 7-(4-fluorophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccc(cc1)F

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CSc1nc2c(csc2c(=O)(nH)1)c1ccc(cc1)F

ZINC62591984

1291486924

7(4FLUOROPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4FLUOROPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4fluorophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC=C(C=C3)F

InChI=1SC13H9FN2OS2c1181315109(61911(10)12(17)1613)7248(14)537h26H1H3(H151617)


BBL000922
Synonyms: 7-(2-chlorophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccccc1Cl

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CSc1nc2c(csc2c(=O)(nH)1)c1ccccc1Cl

ZINC62591985

1291486640

7(2CHLOROPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2CHLOROPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2chlorophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC=CC=C3Cl

InChI=1SC13H9ClN2OS2c1181315108(61911(10)12(17)1613)742359(7)14h26H1H3(H151617)


BBL000923
Synonyms: 7-(3-chlorophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1cccc(c1)Cl

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CSc1nc2c(csc2c(=O)(nH)1)c1cccc(c1)Cl

ZINC62591986

1291487052

7(3CHLOROPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3CHLOROPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3chlorophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC(=CC=C3)Cl

InChI=1SC13H9ClN2OS2c1181315109(61911(10)12(17)1613)73248(14)57h26H1H3(H151617)


BBL000924
Synonyms: 7-(3,4-dichlorophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccc(c(c1)Cl)Cl

more...



CSc1nc2c(csc2c(=O)(nH)1)c1ccc(c(c1)Cl)Cl

ZINC62591989

1291486651

7(34DICHLOROPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34DICHLOROPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34dichlorophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC(=C(C=C3)Cl)Cl

InChI=1SC13H8Cl2N2OS2c1191316107(52011(10)12(18)1713)6238(14)9(15)46h25H1H3(H161718)


BBL000925
Synonyms: 7-(4-bromophenyl)-2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2c(csc2c(=O)[nH]1)c1ccc(cc1)Br

more...



CSc1nc2c(csc2c(=O)(nH)1)c1ccc(cc1)Br

ZINC62591990

1291486560

7(4BROMOPHENYL)2(METHYLSULFANYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4BROMOPHENYL)2(METHYLTHIO)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4bromophenyl)2methylsulfanyl1Hthieno(32d)pyrimidin4one

CSC1=NC(=O)C2=C(N1)C(=CS2)C3=CC=C(C=C3)Br

InChI=1SC13H9BrN2OS2c1181315109(61911(10)12(17)1613)7248(14)537h26H1H3(H151617)


BBL000926
Synonyms: 1-[7-(2-fluorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1nc2c(csc2c(=O)[nH]1)c1ccccc1F

more...



OC(=O)C1CCN(CC1)c1nc2c(csc2c(=O)(nH)1)c1ccccc1F

ZINC49421370

1(7(2FLUOROPHENYL)4OXO34DIHYDROTHIENO(32D)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLICACID

1(7(2FLUOROPHENYL)4OXO3H4HTHIENO(32D)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLICACID

1242870456

1(7(2fluorophenyl)4oxo1Hthieno(32d)pyrimidin2yl)piperidine4carboxylicacid

C1CN(CCC1C(=O)O)C2=NC(=O)C3=C(N2)C(=CS3)C4=CC=CC=C4F

InChI=1SC18H16FN3O3Sc1913421311(13)129261514(12)2018(2116(15)23)227510(6822)17(24)25h14910H58H2(H2425)(H202123)


BBL000927
Synonyms: 7-phenylthieno[3,2-d]pyrimidin-4(3H)-one
Smiles: O=c1[nH]cnc2c1scc2c1ccccc1

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O=c1(nH)cnc2c1scc2c1ccccc1

ZINC02541398

ZINC2541398

156424601

7PHENYL1HTHIENO(32D)PYRIMIDIN4ONE

7PHENYL3HTHIENO(32D)PYRIMIDIN4ONE

7PHENYLTHIENO(32D)PYRIMIDIN4(3H)ONE

C1=CC=C(C=C1)C2=CSC3=C2NC=NC3=O

InChI=1SC12H8N2OSc15121110(1371412)9(61611)8421358h17H(H131415)


BBL000928
Synonyms: 7-(3-methylphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Cc1cccc(c1)c1csc2c1nc[nH]c2=O

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Cc1cccc(c1)c1csc2c1nc(nH)c2=O

ZINC21658109

1031989237

7(3METHYLPHENYL)3H4HTHIENO(32D)PYRIMIDIN4ONE

7(3METHYLPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3methylphenyl)1Hthieno(32d)pyrimidin4one

CC1=CC=CC(=C1)C2=CSC3=C2NC=NC3=O

InChI=1SC13H10N2OSc183249(58)106171211(10)1471513(12)16h27H1H3(H141516)


BBL000929
Synonyms: 7-(4-methylphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Cc1ccc(cc1)c1csc2c1nc[nH]c2=O

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Cc1ccc(cc1)c1csc2c1nc(nH)c2=O

ZINC15829267

1019152045

7(4METHYLPHENYL)3H4HTHIENO(32D)PYRIMIDIN4ONE

7(4METHYLPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(4methylphenyl)1Hthieno(32d)pyrimidin4one

CC1=CC=C(C=C1)C2=CSC3=C2NC=NC3=O

InChI=1SC13H10N2OSc18249(538)106171211(10)1471513(12)16h27H1H3(H141516)


BBL000930
Synonyms: 7-(4-fluorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Fc1ccc(cc1)c1csc2c1nc[nH]c2=O

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Fc1ccc(cc1)c1csc2c1nc(nH)c2=O

ZINC02541400

ZINC2541400

7(4FLUOROPHENYL)1HTHIENO(32D)PYRIMIDIN4ONE

7(4FLUOROPHENYL)3H4HTHIENO(32D)PYRIMIDIN4ONE

7(4FLUOROPHENYL)3HTHIENO(32D)PYRIMIDIN4ONE

7(4FLUOROPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

827614277

C1=CC(=CC=C1C2=CSC3=C2NC=NC3=O)F

InChI=1SC12H7FN2OSc138317(248)95171110(9)1461512(11)16h16H(H141516)


BBL000931
Synonyms: 7-(2-methylphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Cc1ccccc1c1csc2c1nc[nH]c2=O

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Cc1ccccc1c1csc2c1nc(nH)c2=O

ZINC21658111

1030120832

7(2METHYLPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(OTOLYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(2methylphenyl)1Hthieno(32d)pyrimidin4one

CC1=CC=CC=C1C2=CSC3=C2NC=NC3=O

InChI=1SC13H10N2OSc1842359(8)106171211(10)1471513(12)16h27H1H3(H141516)


BBL000932
Synonyms: 7-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)c1csc2c1nc[nH]c2=O

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COc1ccc(cc1)c1csc2c1nc(nH)c2=O

ZINC02541407

ZINC2541407

7(4METHOXYPHENYL)1HTHIENO(32D)PYRIMIDIN4ONE

7(4METHOXYPHENYL)3H4HTHIENO(32D)PYRIMIDIN4ONE

7(4METHOXYPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

827614346

COC1=CC=C(C=C1)C2=CSC3=C2NC=NC3=O

InChI=1SC13H10N2O2Sc1179428(359)106181211(10)1471513(12)16h27H1H3(H141516)


BBL000933
Synonyms: 7-(3,4-diethoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CCOc1cc(ccc1OCC)c1csc2c1nc[nH]c2=O

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CCOc1cc(ccc1OCC)c1csc2c1nc(nH)c2=O

ZINC21658112

1029791545

7(34DIETHOXYPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(34diethoxyphenyl)1Hthieno(32d)pyrimidin4one

CCOC1=C(C=C(C=C1)C2=CSC3=C2NC=NC3=O)OCC

InChI=1SC16H16N2O3Sc1320126510(713(12)2142)118221514(11)1791816(15)19h59H34H212H3(H171819)


BBL000934
Synonyms: 7-(3-fluorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Fc1cccc(c1)c1csc2c1nc[nH]c2=O

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Fc1cccc(c1)c1csc2c1nc(nH)c2=O

ZINC21730793

1031558696

7(3FLUOROPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3fluorophenyl)1Hthieno(32d)pyrimidin4one

C1=CC(=CC(=C1)F)C2=CSC3=C2NC=NC3=O

InChI=1SC12H7FN2OSc1383127(48)95171110(9)1461512(11)16h16H(H141516)


BBL000935
Synonyms: 7-(3-chlorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Clc1cccc(c1)c1csc2c1nc[nH]c2=O

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Clc1cccc(c1)c1csc2c1nc(nH)c2=O

ZINC21658114

1031969455

7(3CHLOROPHENYL)3H4HTHIENO(32D)PYRIMIDIN4ONE

7(3CHLOROPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

7(3chlorophenyl)1Hthieno(32d)pyrimidin4one

C1=CC(=CC(=C1)Cl)C2=CSC3=C2NC=NC3=O

InChI=1SC12H7ClN2OSc1383127(48)95171110(9)1461512(11)16h16H(H141516)


BBL000936
Synonyms: 7-(4-bromophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Brc1ccc(cc1)c1csc2c1nc[nH]c2=O

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Brc1ccc(cc1)c1csc2c1nc(nH)c2=O

ZINC02541404

ZINC2541404

7(4BROMOPHENYL)1HTHIENO(32D)PYRIMIDIN4ONE

7(4BROMOPHENYL)3H4HTHIENO(32D)PYRIMIDIN4ONE

7(4BROMOPHENYL)3HTHIENO(32D)PYRIMIDIN4ONE

7(4BROMOPHENYL)THIENO(32D)PYRIMIDIN4(3H)ONE

827614313

C1=CC(=CC=C1C2=CSC3=C2NC=NC3=O)Br

InChI=1SC12H7BrN2OSc138317(248)95171110(9)1461512(11)16h16H(H141516)


BBL000937
Synonyms: 1-[(2-chloropyridin-3-yl)sulfonyl]azepane
Smiles: Clc1ncccc1S(=O)(=O)N1CCCCCC1

more...



Clc1ncccc1S(=O)(=O)N1CCCCCC1

ZINC35358017

1((2CHLOROPYRIDIN3YL)SULFONYL)AZEPANE

1155081369

1(2chloropyridin3yl)sulfonylazepane

C1CCCN(CC1)S(=O)(=O)C2=C(N=CC=C2)Cl

InChI=1SC11H15ClN2O2Sc121110(6571311)17(1516)1483124914h57H1489H2


BBL000938
Synonyms: 2-chloro-N-phenylpyridine-3-sulfonamide
Smiles: Clc1ncccc1S(=O)(=O)Nc1ccccc1

more...



Clc1ncccc1S(=O)(=O)Nc1ccccc1

1156147964

2CHLORONPHENYLPYRIDINE3SULFONAMIDE

ZINC35186201

C1=CC=C(C=C1)NS(=O)(=O)C2=C(N=CC=C2)Cl

InChI=1SC11H9ClN2O2Sc121110(7481311)17(1516)149521369h1814H


BBL000939
Synonyms: 2-chloro-N-(4-methylphenyl)pyridine-3-sulfonamide
Smiles: Cc1ccc(cc1)NS(=O)(=O)c1cccnc1Cl

more...



Cc1ccc(cc1)NS(=O)(=O)c1cccnc1Cl

1156721640

2CHLORON(4METHYLPHENYL)PYRIDINE3SULFONAMIDE

ZINC35099168

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(N=CC=C2)Cl

InChI=1SC12H11ClN2O2Sc194610(759)1518(1617)113281412(11)13h2815H1H3


BBL000940
Synonyms: 2-chloro-N-(4-fluorophenyl)pyridine-3-sulfonamide
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1cccnc1Cl

more...



Fc1ccc(cc1)NS(=O)(=O)c1cccnc1Cl

1156199653

2CHLORON(4FLUOROPHENYL)PYRIDINE3SULFONAMIDE

ZINC35099158

C1=CC(=C(N=C1)Cl)S(=O)(=O)NC2=CC=C(C=C2)F

InChI=1SC11H8ClFN2O2Sc121110(2171411)18(1617)159538(13)469h1715H


BBL000941
Synonyms: 3-methyl-N-phenyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Cc1nnc2n1cccc2S(=O)(=O)Nc1ccccc1

more...



Cc1nnc2n1cccc2S(=O)(=O)Nc1ccccc1

1291486662

3METHYLNPHENYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62591992

CC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=CC=C3

InChI=1SC13H12N4O2Sc11014151312(85917(10)13)20(1819)16116324711h2916H1H3


BBL000942
Synonyms: 3-ethyl-N-phenyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1ccccc1

more...



CCc1nnc2n1cccc2S(=O)(=O)Nc1ccccc1

1291487063

3ETHYLNPHENYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

MFCD18804100

ZINC62591994

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=CC=C3

InChI=1SC14H14N4O2Sc121315161412(961018(13)14)21(1920)17117435811h31017H2H21H3


BBL000943
Synonyms: N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Cc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2

more...



Cc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2

1291486797

N(3METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62591995

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3

InChI=1SC13H12N4O2Sc11042511(810)1620(1819)12637179141513(12)17h2916H1H3


BBL000944
Synonyms: 3-methyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Cc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C

more...



Cc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C

1291487110

3METHYLN(3METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62591998

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3C

InChI=1SC14H14N4O2Sc11053612(910)1721(1920)137481811(2)151614(13)18h3917H12H3


BBL000945
Synonyms: 3-ethyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1cccc(c1)C

more...



CCc1nnc2n1cccc2S(=O)(=O)Nc1cccc(c1)C

1291486504

3ETHYLN(3METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62591999

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=CC(=C3)C

InChI=1SC15H16N4O2Sc131416171513(85919(14)15)22(2021)181274611(2)1012h41018H3H212H3


BBL000946
Synonyms: 3-methyl-N-(4-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Cc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C

more...



Cc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C

1291486673

3METHYLN(4METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592000

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3C

InChI=1SC14H14N4O2Sc1105712(8610)1721(1920)134391811(2)151614(13)18h3917H12H3


BBL000947
Synonyms: 3-ethyl-N-(4-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(cc1)C

more...



CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(cc1)C

1291486684

3ETHYLN(4METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592002

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)C

InChI=1SC15H16N4O2Sc131416171513(541019(14)15)22(2021)18128611(2)7912h41018H3H212H3


BBL000948
Synonyms: N-(3-fluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C

more...



Fc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C

1291487074

N(3FLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592003

CC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC=C3)F

InChI=1SC13H11FN4O2Sc1915161312(63718(9)13)21(1920)171152410(14)811h2817H1H3


BBL000949
Synonyms: 4-(3-methoxyphenyl)-6-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3,4-dihydropyrimidine-2(1H)-thione
Smiles: COc1cccc(c1)C1NC(=S)NC(=C1c1onc(n1)c1ccc(cc1)C)C

more...



COc1cccc(c1)C1NC(=S)NC(=C1c1onc(n1)c1ccc(cc1)C)C

4(3methoxyphenyl)6methyl5(3(4methylphenyl)124oxadiazol5yl)34dihydropyrimidine2(1H)thione

892302306


BBL000950
Synonyms: 6-methyl-4-(3-methylphenyl)-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3,4-dihydropyrimidine-2(1H)-thione
Smiles: S=C1NC(=C(C(N1)c1cccc(c1)C)c1onc(n1)c1ccc(cc1)C)C

more...



S=C1NC(=C(C(N1)c1cccc(c1)C)c1onc(n1)c1ccc(cc1)C)C

6methyl4(3methylphenyl)5(3(4methylphenyl)124oxadiazol5yl)34dihydropyrimidine2(1H)thione

892302226


BBL000951
Synonyms: 3-ethyl-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1cccc(c1)F

more...



CCc1nnc2n1cccc2S(=O)(=O)Nc1cccc(c1)F

1291486537

3ETHYLN(3FLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592005

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC=C3)F

InChI=1SC14H13FN4O2Sc121316171412(74819(13)14)22(2021)181163510(15)911h3918H2H21H3


BBL000952
Synonyms: N-(4-fluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C

more...



Fc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C

1291487085

N(4FLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592006

CC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)F

InChI=1SC13H11FN4O2Sc1915161312(32818(9)13)21(1920)17116410(14)5711h2817H1H3


BBL000953
Synonyms: 3-ethyl-N-(4-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(cc1)F

more...



CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(cc1)F

1291487121

3ETHYLN(4FLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592007

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)F

InChI=1SC14H13FN4O2Sc121316171412(43919(13)14)22(2021)18117510(15)6811h3918H2H21H3


BBL000954
Synonyms: N-(4-ethylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2

more...



CCc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2

1291486695

N(4ETHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592009

CCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3

InChI=1SC14H14N4O2Sc12115712(8611)1721(1920)134391810151614(13)18h31017H2H21H3


BBL000955
Synonyms: N-(4-ethylphenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C

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CCc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C

1291487030

N(4ETHYLPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592010

CCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3C

InChI=1SC15H16N4O2Sc13126813(9712)1822(2021)1454101911(2)161715(14)19h41018H3H212H3


BBL000956
Synonyms: 3-ethyl-N-(4-ethylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2CC

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CCc1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2CC

1291486888

3ETHYLN(4ETHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592012

CCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3CC

InChI=1SC16H18N4O2Sc13127913(10812)1923(2122)1465112015(42)171816(14)20h51119H34H212H3


BBL000957
Synonyms: N-(3,4-dimethylphenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(c(c1)C)C

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CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(c(c1)C)C

1291486800

N(34DIMETHYLPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592014

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=C(C=C3)C)C

InChI=1SC16H18N4O2Sc141517181614(65920(15)16)23(2122)19138711(2)12(3)1013h51019H4H213H3


BBL000958
Synonyms: N-(3,5-dimethylphenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Cc1cc(cc(c1)C)NS(=O)(=O)c1cccn2c1nnc2

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Cc1cc(cc(c1)C)NS(=O)(=O)c1cccn2c1nnc2

1291486708

N(35DIMETHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592015

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3)C

InChI=1SC14H14N4O2Sc110611(2)812(710)1721(1920)13435189151614(13)18h3917H12H3


BBL000959
Synonyms: N-(3,5-dimethylphenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Cc1cc(C)cc(c1)NS(=O)(=O)c1cccn2c1nnc2C

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Cc1cc(C)cc(c1)NS(=O)(=O)c1cccn2c1nnc2C

1291486946

N(35DIMETHYLPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592017

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3C)C

InChI=1SC15H16N4O2Sc110711(2)913(810)1822(2021)145461912(3)161715(14)19h4918H13H3


BBL000960
Synonyms: N-(3,5-dimethylphenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1cc(C)cc(c1)C

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CCc1nnc2n1cccc2S(=O)(=O)Nc1cc(C)cc(c1)C

1291486719

N(35DIMETHYLPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592018

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC(=C3)C)C

InChI=1SC16H18N4O2Sc141517181614(65720(15)16)23(2122)1913911(2)812(3)1013h51019H4H213H3


BBL000961
Synonyms: N-(3,4-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Fc1ccc(cc1F)NS(=O)(=O)c1cccn2c1nnc2

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Fc1ccc(cc1F)NS(=O)(=O)c1cccn2c1nnc2

1291486526

N(34DIFLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592019

C1=CN2C=NN=C2C(=C1)S(=O)(=O)NC3=CC(=C(C=C3)F)F

InChI=1SC12H8F2N4O2Sc139438(610(9)14)1721(1920)11215187151612(11)18h1717H


BBL000962
Synonyms: N-(3,4-difluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Fc1cc(ccc1F)NS(=O)(=O)c1cccn2c1nnc2C

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Fc1cc(ccc1F)NS(=O)(=O)c1cccn2c1nnc2C

N(34DIFLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592020


BBL000963
Synonyms: N-(3,4-difluorophenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(c(c1)F)F

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CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(c(c1)F)F

N(34DIFLUOROPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592021


BBL000964
Synonyms: N-(3-chlorophenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Clc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2

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Clc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2

1291487154

N(3CHLOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592023

C1=CC(=CC(=C1)Cl)NS(=O)(=O)C2=CC=CN3C2=NN=C3

InChI=1SC12H9ClN4O2Sc13931410(79)1620(1819)11526178141512(11)17h1816H


BBL000965
Synonyms: N-(3-chlorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Clc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C

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Clc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C

1291486775

N(3CHLOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592024

CC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC=C3)Cl

InChI=1SC13H11ClN4O2Sc1915161312(63718(9)13)21(1920)171152410(14)811h2817H1H3


BBL000966
Synonyms: N-(3-chlorophenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1cccc(c1)Cl

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CCc1nnc2n1cccc2S(=O)(=O)Nc1cccc(c1)Cl

1291486935

N(3CHLOROPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE

ZINC62592025

CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC=C3)Cl

InChI=1SC14H13ClN4O2Sc121316171412(74819(13)14)22(2021)181163510(15)911h3918H2H21H3


BBL000967
Synonyms: methyl3-(chlorosulfonyl)-4-(4-methylphenyl)thiophene-2-carboxylate
Smiles: COC(=O)c1scc(c1S(=O)(=O)Cl)c1ccc(cc1)C

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COC(=O)c1scc(c1S(=O)(=O)Cl)c1ccc(cc1)C

1291486593

METHYL3(CHLOROSULFONYL)4(4METHYLPHENYL)THIOPHENE2CARBOXYLATE

ZINC101374373

methyl3chlorosulfonyl4(4methylphenyl)thiophene2carboxylate

CC1=CC=C(C=C1)C2=CSC(=C2S(=O)(=O)Cl)C(=O)OC

InChI=1SC13H11ClO4S2c18359(648)1071911(13(15)182)12(10)20(1416)17h37H12H3


BBL000968
Synonyms: ethyl3-(chlorosulfonyl)-4-(4-methylphenyl)thiophene-2-carboxylate
Smiles: CCOC(=O)c1scc(c1S(=O)(=O)Cl)c1ccc(cc1)C

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CCOC(=O)c1scc(c1S(=O)(=O)Cl)c1ccc(cc1)C

ETHYL3(CHLOROSULFONYL)4(4METHYLPHENYL)THIOPHENE2CARBOXYLATE

1291486899

ZINC100027240

ethyl3chlorosulfonyl4(4methylphenyl)thiophene2carboxylate

CCOC(=O)C1=C(C(=CS1)C2=CC=C(C=C2)C)S(=O)(=O)Cl

InChI=1SC14H13ClO4S2c131914(16)1213(21(1517)18)11(82012)10649(2)5710h48H3H212H3


BBL000969
Synonyms: methyl3-(chlorosulfonyl)-4-phenylthiophene-2-carboxylate
Smiles: COC(=O)c1scc(c1S(=O)(=O)Cl)c1ccccc1

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COC(=O)c1scc(c1S(=O)(=O)Cl)c1ccccc1

2METHOXYCARBONYL4PHENYLTHIOPHEN3YLSULFONYLCHLORIDE

METHYL3(CHLOROSULFONYL)4PHENYLTHIOPHENE2CARBOXYLATE

ZINC102917265

methyl3chlorosulfonyl4phenylthiophene2carboxylate

COC(=O)C1=C(C(=CS1)C2=CC=CC=C2)S(=O)(=O)Cl

InChI=1SC12H9ClO4S2c11712(14)1011(19(1315)16)9(71810)8532468h27H1H3


BBL000970
Synonyms: methyl3-(chlorosulfonyl)-4-(3-fluorophenyl)thiophene-2-carboxylate
Smiles: COC(=O)c1scc(c1S(=O)(=O)Cl)c1cccc(c1)F

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COC(=O)c1scc(c1S(=O)(=O)Cl)c1cccc(c1)F

1291487041

METHYL3(CHLOROSULFONYL)4(3FLUOROPHENYL)THIOPHENE2CARBOXYLATE

ZINC100027246

methyl3chlorosulfonyl4(3fluorophenyl)thiophene2carboxylate

COC(=O)C1=C(C(=CS1)C2=CC(=CC=C2)F)S(=O)(=O)Cl

InChI=1SC12H8ClFO4S2c11812(15)1011(20(1316)17)9(61910)73248(14)57h26H1H3


BBL000971
Synonyms: methyl4-(4-chlorophenyl)-3-(chlorosulfonyl)thiophene-2-carboxylate
Smiles: COC(=O)c1scc(c1S(=O)(=O)Cl)c1ccc(cc1)Cl

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COC(=O)c1scc(c1S(=O)(=O)Cl)c1ccc(cc1)Cl

1291486731

METHYL4(4CHLOROPHENYL)3(CHLOROSULFONYL)THIOPHENE2CARBOXYLATE

ZINC100027252

methyl4(4chlorophenyl)3chlorosulfonylthiophene2carboxylate

COC(=O)C1=C(C(=CS1)C2=CC=C(C=C2)Cl)S(=O)(=O)Cl

InChI=1SC12H8Cl2O4S2c11812(15)1011(20(1416)17)9(61910)7248(13)537h26H1H3


BBL000972
Synonyms: methyl3-(chlorosulfonyl)-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1S(=O)(=O)Cl)cccc2

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COC(=O)c1sc2c(c1S(=O)(=O)Cl)cccc2

74370960

METHYL3(CHLOROSULFONYL)1BENZOTHIOPHENE2CARBOXYLATE

ZINC100027250

methyl3chlorosulfonyl1benzothiophene2carboxylate

COC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)Cl

InChI=1SC10H7ClO4S2c11510(12)89(17(1113)14)642357(6)168h25H1H3


BBL000973
Synonyms: methyl5-(chlorosulfonyl)-1H-pyrazole-4-carboxylate
Smiles: COC(=O)c1cn[nH]c1S(=O)(=O)Cl

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COC(=O)c1cn(nH)c1S(=O)(=O)Cl

1532000546

METHYL5(CHLOROSULFONYL)1HPYRAZOLE4CARBOXYLATE

ZINC100027226

methyl5chlorosulfonyl1Hpyrazole4carboxylate

COC(=O)C1=C(NN=C1)S(=O)(=O)Cl

InChI=1SC5H5ClN2O4Sc1125(9)32784(3)13(610)11h2H1H3(H78)


BBL000974
Synonyms: ethyl5-(chlorosulfonyl)-3-ethyl-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1c(CC)n[nH]c1S(=O)(=O)Cl

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CCOC(=O)c1c(CC)n(nH)c1S(=O)(=O)Cl

ETHYL5(CHLOROSULFONYL)3ETHYL1HPYRAZOLE4CARBOXYLATE

ZINC101374392


BBL000975
Synonyms: (4,4-dioxido-1H-4,1,2-benzothiadiazin-3-yl)(pyrrolidin-1-yl)methanone
Smiles: O=C(C1=NNc2c(S1(=O)=O)cccc2)N1CCCC1

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O=C(C1=NNc2c(S1(=O)=O)cccc2)N1CCCC1

ZINC62592026

(44DIOXIDO1H412BENZOTHIADIAZIN3YL)(PYRROLIDIN1YL)METHANONE

1474056808

3(PYRROLIDIN1YLCARBONYL)1H412BENZOTHIADIAZINE44DIOXIDE

(44dioxo1H4$l^(6)12benzothiadiazin3yl)pyrrolidin1ylmethanone

C1CCN(C1)C(=O)C2=NNC3=CC=CC=C3S2(=O)=O

InChI=1SC12H13N3O3Sc1612(15734815)1114139512610(9)19(1117)18h125613H3478H2


BBL000976
Synonyms: (4,4-dioxido-1H-4,1,2-benzothiadiazin-3-yl)(piperidin-1-yl)methanone
Smiles: O=C(C1=NNc2c(S1(=O)=O)cccc2)N1CCCCC1

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O=C(C1=NNc2c(S1(=O)=O)cccc2)N1CCCCC1

ZINC49402787

(44DIOXIDO1H412BENZOTHIADIAZIN3YL)(PIPERIDIN1YL)METHANONE

178675019

3(PIPERIDIN1YLCARBONYL)1H412BENZOTHIADIAZINE44DIOXIDE

(44dioxo1H4$l^(6)12benzothiadiazin3yl)piperidin1ylmethanone

C1CCN(CC1)C(=O)C2=NNC3=CC=CC=C3S2(=O)=O

InChI=1SC13H15N3O3Sc1713(168415916)12151410623711(10)20(1218)19h236714H14589H2

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