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COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1649271
Total number of pages: 1650 ( 1000 items on each page )
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BBL002987
Synonyms: 2-[bis(4-hydroxyphenyl)methyl]benzoicacid
Smiles: Oc1ccc(cc1)C(c1ccccc1C(=O)O)c1ccc(cc1)O
Oc1ccc(cc1)C(c1ccccc1C(=O)O)c1ccc(cc1)O
PHENOLPHTHALIN
ZINC000004284459
ZINC4284459
81903
ALPHAALPHABIS(4HYDROXYPHENYL)OTOLUICACID
ALPHAALPHABIS(PHYDROXYPHENYL)OTOLUICACID
BENZOICACID2(BIS(4HYDROXYPHENYL)METHYL)
MFCD00036135
C1=CC=C(C(=C1)C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)C(=O)O
InChI=1SC20H16O4c21159513(61015)19(1471116(22)12814)17312418(17)20(23)24h112192122H(H2324)
BBL002988
Synonyms: N,N-bis{2-[bis(carboxymethyl)amino]ethyl}glycine
Smiles: OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
PENTA(CARBOXYMETHYL)DIETHYLENETRIAMINE
PENTACARBOXYMETHYLDIETHYLENETRIAMINE
PENTETATE
PENTETATES
PENTETICACID
PENTETICACID(USANINNBAN)
PENTETICACID(USPINN)
PENTETICACIDDTPA
PENTHAMIL
PENTHAMIL(VAN)
PENTHANIL
TECHNETIUMTC99MPENTETATEKIT
TETRALONB(SALTMIX)
ZINC000019419017
ZINC19419017
ZINCDTPA
(((CARBOXYMETHYL)IMINO)BIS(ETHYLENENITRILO))TETRAACETICACID
(CARBOXYMETHYLIMINO)BIS(ETHYLENENITRILO)TETRAACETICACID
(DIETHYLENETRIAMINE)PENTAACETICACID
(DIETHYLENETRINITRILO)PENTAACETICACID
2((2((2(BIS(CARBOXYMETHYL)AMINO)ETHYL)(CARBOXYMETHYL)AMINO)ETHYL)(CARBOXYMETHYL)AMINO)ACETICACID
2(BIS((2(BIS(CARBOXYMETHYL)AMINO)ETHYL))AMINO)ACETICACID
2(BIS(2(BIS(CARBOXYMETHYL)AMINO)ETHYL)AMINO)ACETICACID
22(CARBOXYMETHYLIMINO)BIS(ETHYLIMINODIESSIGSAEURE)
369TRIAZAUNDECANEDIOICACID369TRIS(CARBOXYMETHYL)
39TRIAZAUNDECANEDIOICACID369TRIS(CARBOXYMETHYL)
67436
ACETICACID(((CARBOXYMETHYLIMINO)BIS(ETHYLENENITRILO))TETRA)
ACETICACID((CARBOXYMETHYLIMINO)BIS(ETHYLENENITRILO))TETRA
ACETICACID222(((CARBOXYMETHYL)IMINO)BIS(21ETHANEDIYLNITRILO))TETRAKIS
ACIDEPENTETIQUE
ACIDEPENTETIQUE(INNFRENCH)
ACIDOPENTETICO
ACIDUMPENTETICUM
ACIDUMPENTETICUM(INNLATIN)
((((CARBOXYMETHYL)IMINO)BIS(ETHYLENENITRILO))TETRAACETIC)ACID
(((CARBOXYMETHYL)IMINO)BIS(12ETHANEDIYLNITRILO)TETRAACETICACID)
DIETHYLENETRIAMINEPENTAACETICACID
DIETHYLENETRIAMINEPENTAACETICACID(NOTETHESODIUMSALTSARENAMEDASFOLLOWSPENTETATEMONOSODIUM(1NAION)PENTETATEDISODIUM(2NAIONS)PENTETATETRISODIUM(3NAIONS)PENTETATETETRASODIUM(4NAIONS)PENTETATEPENTASODIUM(5NAIONS))
DIETHYLENETRIAMINEPENTACETICACID
DISSOLVINED
GLYCINE(NNBIS(2(BIS(CARBOXYMETHYL)AMINO)ETHYL))
GLYCINENBIS(2(BIS(CARBOXYMETHYL)AMINO)ETHYL)
GLYCINENNBIS(2(BIS(CARBOXYMETHYL)AMINO)ETHYL)
INDIUMDTPA
MFCD00004289
N(NBIS(2(BIS(CARBOXYMETHYL)AMINO)ETHYL)GLYCINE)
NCARBOXYMETHYLIMINOBIS(ETHYLENENITRILO)TETRA(ACETICACID)
NNBIS(2(BIS(CARBOXYMETHYL)AMINO)ETHYL)GLYCINE
NNNNNDIETHYLENETRIAMINEPENTAACETICACID
CALCIUMTRISODIUMPENTETATE
DIETHYLENETRIAMINENNNNNPENTAACETICACID
DIETHYLENETRIAMINENNNNPENTAACETICACID
C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O
InChI=1SC14H23N3O10c1810(19)515(1316(611(20)21)712(22)23)2417(813(24)25)914(26)27h19H2(H1819)(H2021)(H2223)(H2425)(H2627)
BBL002989
Synonyms: 1-(anthracen-9-yl)ethanone
Smiles: CC(=O)c1c2ccccc2cc2c1cccc2
CC(=O)c1c2ccccc2cc2c1cccc2
ETHANONE1(9ANTHRACENYL)
KETONE9ANTHRYLMETHYL
MFCD00001259
ZINC000001587882
ZINC01587882
ZINC1587882
1(9ANTHRYL)ETHANONE
1(ANTHRACEN9YL)ETHAN1ONE
1(ANTHRACEN9YL)ETHANONE
1ANTHRACEN9YLETHANONE
784043
9ACETOANTHRACENE
9ACETYLANTHRACENE
9ACETYLANTHRANCENE
9ANTHRYLMETHYLKETONE
CC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31
InChI=1SC16H12Oc111(17)1614842612(14)1013735915(13)16h210H1H3
BBL002990
Synonyms: pentadecan-8-one
Smiles: CCCCCCCC(=O)CCCCCCC
CCCCCCCC(=O)CCCCCCC
DIHEPTYLKETONE
DINHEPTYLKETONE
HEPTYLKETONE
818235
8OXOPENTADECANE
8PENTADECANONE
CAPRYLONE
CAPRYLONEGURUDEEBANSATYAVANI
MFCD00009555
PENTADECAN8ONE
PENTADECANE8ONE
SATURATEDFATTYACID
ZINC000001596361
ZINC1596361
InChI=1SC15H30Oc13579111315(16)1412108642h314H212H3
BBL002991
Synonyms: 2-amino-5-methylphenol
Smiles: Cc1ccc(c(c1)O)N
Cc1ccc(c(c1)O)N
MCRESOL6AMINO
MFCD00007693
PHENOL2AMINO5METHYL
ZINC000000388270
ZINC00388270
ZINC388270
2835985
2AMINO5METHYLPHENOL
2HYDROXY4METHYLANILIN
2HYDROXY4METHYLANILINE
2HYDROXYPTOLUIDINE
3METHYL6AMINOPHENOL
4AMINO3HYDROXYTOLUENE
4AMINO5HYDROXYTOLUENE
6AMINO3CRESOL
6AMINO3METHYLPHENOL
6AMINOMCRESOL
CC1=CC(=C(C=C1)N)O
InChI=1SC7H9NOc15236(8)7(9)45h249H8H21H3
BBL002992
Synonyms: N-ethyl-2,4-dinitroaniline
Smiles: CCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
CCNc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
(24DINITROPHENYL)ETHYLAMINE
24DINITRONETHYLANILINE
3846502
BENZENAMINENETHYL24DINITRO
MFCD00007225
N1ETHYL24DINITROANILINE
NETHYL24DINITROANILINE
ZINC000003861396
ZINC03861396
ZINC3861396
CCNC1=C(C=C(C=C1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC8H9N3O4c1297436(10(12)13)58(7)11(14)15h359H2H21H3
BBL002993
Synonyms: 1-chloro-2-methoxy-4-nitrobenzene
Smiles: COc1cc(ccc1Cl)[N+](=O)[O-]
COc1cc(ccc1Cl)(N+)(=O)(O)
MFCD00079739
ZINC000002004522
ZINC02004522
ZINC2004522
1009365
1CHLORO2(METHYLOXY)4NITROBENZENE
1CHLORO2METHOXY4NITROBENZENE
2CHLORO5NITROANISOL
2CHLORO5NITROANISOLE
2METHOXY4NITROCHLOROBENZENE
4CHLORO3METHOXYNITROBENZENE
BENZENE1CHLORO2METHOXY4NITRO
COC1=C(C=CC(=C1)(N+)(=O)(O))Cl
InChI=1SC7H6ClNO3c112745(9(10)11)236(7)8h24H1H3
BBL002994
Synonyms: N,N'-dibenzylethane-1,2-diamine
Smiles: N(Cc1ccccc1)CCNCc1ccccc1
N(Cc1ccccc1)CCNCc1ccccc1
N1N2DIBENZYLETHANE12DIAMINE
NNBIS(PHENYLMETHYL)12ETHANEDIAMINE
NNDIBENZYL12ETHANEDIAMINE
NNDIBENZYL12ETHYLENEDIAMINE
NNDIBENZYLETHANE12DIAMINE
NNDIBENZYLETHYLENEDIAMINE
ZINC000019366161
ZINC19366161
122758
12BIS(BENZYLAMINO)ETHANE
12ETHANEDIAMINEN1N2BIS(PHENYLMETHYL)
12ETHANEDIAMINEN1N2BIS(PHENYLMETHYL)ACETATE(12)
12ETHANEDIAMINENNBIS(PHENYLMETHYL)
1NNBIS(PHENYLMETHYL)
BENZYL(2(BENZYLAMINO)ETHYL)AMINE
ETHYLENEDIAMINENDIBENZYL
ETHYLENEDIAMINENNDIBENZYL
MFCD00004771
C1=CC=C(C=C1)CNCCNCC2=CC=CC=C2
InChI=1SC16H20N2c13715(841)1317111218141695261016h1101718H1114H2
BBL002995
Synonyms: benzene-1,2,4-triyltriacetate
Smiles: CC(=O)Oc1ccc(c(c1)OC(=O)C)OC(=O)C
CC(=O)Oc1ccc(c(c1)OC(=O)C)OC(=O)C
HYDROXYHYDROQUINONETRIACETATE
MFCD00008700
PYROGALLOLA
TRIACETATEDHYDROXYHYDROQUINONE
TRIACETATEDHYDROXYHYDROQUINONE(FRENCH)
ZINC000000056433
ZINC00056433
ZINC56433
(25DIACETYLOXYPHENYL)ACETATE
(34DIACETOXYPHENYL)ACETATE
(34DIACETYLOXYPHENYL)ACETATE
124BENZENETRIACETATE
124BENZENETRIOL124TRIACETATE
124BENZENETRIOLTRIACETATE
124PHENENYLTRIACETATE
124TRIACETOXYBENZENE
14BENZENETRIOLTRIACETATE
14TRIACETOXYBENZENE
24BIS(ACETYLOXY)PHENYLACETATE
24DIACETYLOXYPHENYLACETATE
2HYDROXYHYDROQUINONETRIACETATE
34BIS(ACETYLOXY)PHENYLACETATE
613036
BENZENE124TRIYLTRIACETATE
CC(=O)OC1=CC(=C(C=C1)OC(=O)C)OC(=O)C
InChI=1SC12H12O6c17(13)16104511(178(2)14)12(610)189(3)15h46H13H3
BBL002996
Synonyms: 1-cyclohexylurea
Smiles: NC(=O)NC1CCCCC1
NC(=O)NC1CCCCC1
NCYCLOHEXLUREA
NCYCLOHEXYLUREA
UREACYCLOHEXYL
UREANCYCLOHEXYL
ZINC000000162621
ZINC00162621
ZINC162621
1CYCLOHEXYLUREA
698908
AMINONCYCLOHEXYLAMIDE
CYCLOHEXYLUREA
MFCD00014286
MONOCYCLOHEXYLUREA
C1CCC(CC1)NC(=O)N
InChI=1SC7H14N2Oc87(10)96421356h6H15H2(H38910)
BBL002997
Synonyms: 4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1NC(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl
O=C1NC(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl
4567tetrachloro1Hisoindole13(2H)dione
PHTHALIMIDE456TETRACHLORO
TETRACHLOROPHTHALIMIDE
ZINC000000388224
ZINC00388224
ZINC388224
1571137
356TETRACHLOROPHTHALIMIDE
MFCD00005883
4567tetrachloroisoindole13dione
C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)NC2=O
InChI=1SC8HCl4NO2c9312(8(15)137(1)14)4(10)6(12)5(3)11h(H131415)
BBL002998
Synonyms: 1,3-bis(trichloromethyl)benzene
Smiles: ClC(c1cccc(c1)C(Cl)(Cl)Cl)(Cl)Cl
ClC(c1cccc(c1)C(Cl)(Cl)Cl)(Cl)Cl
DITRICHLOROMETHYLMXYLENE
HEXACHLOROMETAXYLOL
13BIS(TRICHLOROMETHYL)BENZENE
13DI(TRICHLOROMETHYL)BENZENE
3(TRICHLOROMETHYL)BENZOTRICHLORIDE
881992
AAAAAAHEXACHLOROMXYLENE
ALPHAALPHAALPHAALPHAALPHAALPHAHEXACHLOROMXYLENE
ALPHAALPHAALPHAALPHAALPHAALPHAHEXACHLOROXYLENE
ALPHAALPHAALPHAALPHAALPHAALPHAHEXACHLOROXYLENE(RELATED)
ALPHAALPHAALPHAALPHAALPHAHEXACHLOROMXYLENE
ALPHAALPHAALPHAALPHAALPHAHEXACHLOROXYLENE
ALPHAALPHAHEXACHLOROMXYLENE
BENZENE13BIS(TRICHLOROMETHYL)
BENZENE3BIS(TRICHLOROMETHYL)
MBIS(TRICHLORMETHYL)BENZENE
MBIS(TRICHLOROMETHYL)BENZENE
MBIS(TRICHOLORMETHYL)BENZENE
MFCD00018821
MXYLENEALPHAALPHAALPHAALPHAALPHAALPHAHEXACHLORO
MXYLENEALPHAALPHAALPHAALPHAALPHAHEXACHLORO
MXYLENEHEXACHLORIDE
ZINC000001673614
ZINC01673614
ZINC1673614
C1=CC(=CC(=C1)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
InChI=1SC8H4Cl6c97(1011)52136(45)8(1213)14h14H
BBL002999
Synonyms: 1,3-dibutylthiourea
Smiles: CCCCNC(=S)NCCCC
CCCCNC(=S)NCCCC
DIBUTYLTHIOUREA
109466
13DIBUTYL2THIOUREA
13DIBUTYLTHIOUREA
13DINBUTYL2THIOUREA
13DINBUTYLTHIOUREA
BIS(BUTYLAMINO)METHANE1THIONE
MFCD00004926
NNDIBUTYLTHIOUREA
NNDIBUTYLTHIOUREA(13DIBUTYL2THIOUREA)
NNDINBUTYLTHIOUREA
NNDINORMALBUTYLTHIOUREA
THIATEU
THIOUREANDIBUTYL
THIOUREANNDIBUTYL
UREA13DIBUTYL2THIO
UREA13DIBUTYL2THIO(8CI)
UREA3DIBUTYL2THIO
ZINC000003875766
ZINC03875766
ZINC3875766
InChI=1SC9H20N2Sc1357109(12)118642h38H212H3(H2101112)
BBL003000
Synonyms: ethanedioicacid
Smiles: OC(=O)C(=O)O
OC(=O)C(=O)O
OXALATE
OXALATESTANDARDFORIC
OXALICACID
OXALICACID(8CI)
OXALICACID2HYDRATE
OXALICACIDANHYDROUS
OXALICACIDDIAMMONIUMSALT
OXALICACIDDIANION
OXALICACIDSOLUTION
OXALICACIDSTANDARDSOLUTION
ULTRAPLASTACTIVATES52
URANIUMBIS(ETHANEDIOATO(2)KO1KO2)(T4)
ZINC6021239
DICARBOXYLICACID(C46)
ETHANE12DIOATE
ETHANE12DIOICACID
ETHANEDIOICACID
ETHANEDIOICACID(9CI)
ETHANEDIONATE
ETHANEDIONICACID
144627
2OXO2OXONIOACETATE
ACIDUMOXALICUM
AMMONIUMOXALATEETHANE12DIOATE
MFCD00002573
C(=O)(C(=O)O)O
InChI=1SC2H2O4c31(4)2(5)6h(H34)(H56)
BBL003001
Synonyms: anthracene-9,10-dione
Smiles: O=C1c2ccccc2C(=O)c2c1cccc2
O=C1c2ccccc2C(=O)c2c1cccc2
ZINC03847491
ZINC3847491
84651
910ANTHRACENDION
910ANTHRACENEDIONE
910ANTHRACHINOE
910ANTHRACHINON
910ANTHRAQUINONE
910DIHYDRO910DIOXOANTHRACENE
910DIHYDROANTHRACENE910DIONE
910DIOXOANTHRACENE
910QUINONE
ANTHRA910QUINONE
ANTHRACENE10DIHYDRO910DIOXO
ANTHRACENE910DIHYDRO910DIOXO
ANTHRACENE910DIONE
ANTHRACENE910QUINONE
ANTHRACENEQUINONE
ANTHRACHINON
ANTHRADIONE
ANTHRAPEL
ANTHRAQUINONE
ANTHRAQUINONE(BSIISO)
BISALKYLAMINOANTHRAQUINONE
C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O
InChI=1SC14H8O2c15139512610(9)14(16)12843711(12)13h18H
BBL003002
Synonyms: tert-butyl(1-{[1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}piperidin-4-yl)carbamate
Smiles: O=C(OC(C)(C)C)NC1CCN(CC1)C(=O)c1nnn(c1)c1cccc(c1)Cl
O=C(OC(C)(C)C)NC1CCN(CC1)C(=O)c1nnn(c1)c1cccc(c1)Cl
TERTBUTYL(1((1(3CHLOROPHENYL)1H123TRIAZOL4YL)CARBONYL)PIPERIDIN4YL)CARBAMATE
1260628634
ZINC57509233
tertbutylN(1(1(3chlorophenyl)triazole4carbonyl)piperidin4yl)carbamate
CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C2=CN(N=N2)C3=CC(=CC=C3)Cl
InChI=1SC19H24ClN5O3c119(23)2818(27)21147924(10814)17(26)161225(232216)1564513(20)1115h46111214H710H213H3(H2127)
BBL003003
Synonyms: 5-amino-1-(3-chloro-4-methoxyphenyl)-N-(3-chloro-4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: COc1ccc(cc1Cl)n1nnc(c1N)C(=O)Nc1ccc(c(c1)Cl)C
COc1ccc(cc1Cl)n1nnc(c1N)C(=O)Nc1ccc(c(c1)Cl)C
ZINC57509168
1260904480
5AMINO1(3CHLORO4METHOXYPHENYL)N(3CHLORO4METHYLPHENYL)1H123TRIAZOLE4CARBOXAMIDE
5amino1(3chloro4methoxyphenyl)N(3chloro4methylphenyl)triazole4carboxamide
CC1=C(C=C(C=C1)NC(=O)C2=C(N(N=N2)C3=CC(=C(C=C3)OC)Cl)N)Cl
InChI=1SC17H15Cl2N5O2c193410(712(9)18)2117(25)1516(20)24(232215)115614(262)13(19)811h38H20H212H3(H2125)
BBL003004
Synonyms: 5,7-dichloro-3-(phenylsulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Smiles: Clc1ccc2c(c1)c(Cl)nc1n2nnc1S(=O)(=O)c1ccccc1
Clc1ccc2c(c1)c(Cl)nc1n2nnc1S(=O)(=O)c1ccccc1
57DICHLORO3(PHENYLSULFONYL)(123)TRIAZOLO(15A)QUINAZOLINE
ZINC57508960
3(benzenesulfonyl)57dichlorotriazolo(15a)quinazoline
C1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=C(N3N=N2)C=CC(=C4)Cl)Cl
InChI=1SC15H8Cl2N4O2Sc169671211(89)13(17)181415(192021(12)14)24(2223)104213510h18H
BBL003005
Synonyms: 5-chloro-3-[(4-fluorophenyl)sulfonyl][1,2,3]triazolo[1,5-a]quinazoline
Smiles: Fc1ccc(cc1)S(=O)(=O)c1nnn2c1nc(Cl)c1c2cccc1
Fc1ccc(cc1)S(=O)(=O)c1nnn2c1nc(Cl)c1c2cccc1
5CHLORO3((4FLUOROPHENYL)SULFONYL)(123)TRIAZOLO(15A)QUINAZOLINE
ZINC57508958
5chloro3(4fluorophenyl)sulfonyltriazolo(15a)quinazoline
C1=CC=C2C(=C1)C(=NC3=C(N=NN23)S(=O)(=O)C4=CC=C(C=C4)F)Cl
InChI=1SC15H8ClFN4O2Sc161311312412(11)2114(1813)15(192021)24(2223)10759(17)6810h18H
BBL003006
Synonyms: 5-{[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl}-2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4(5H)-one
Smiles: ClCc1onc(n1)Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)F
ClCc1onc(n1)Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)F
ZINC57509274
1260912864
5((5(CHLOROMETHYL)124OXADIAZOL3YL)METHYL)2(4FLUOROPHENYL)PYRAZOLO(15A)PYRAZIN4(5H)ONE
5((5(chloromethyl)124oxadiazol3yl)methyl)2(4fluorophenyl)pyrazolo(15a)pyrazin4one
C1=CC(=CC=C1C2=NN3C=CN(C(=O)C3=C2)CC4=NOC(=N4)CCl)F
InChI=1SC16H11ClFN5O2c178151914(212515)922562313(16(22)24)712(2023)101311(18)4210h17H89H2
BBL003007
Synonyms: 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one
Smiles: CC1CCC2(CC1)NC(=O)C(=N2)c1ccccc1
CC1CCC2(CC1)NC(=O)C(=N2)c1ccccc1
1202247399
8METHYL3PHENYL14DIAZASPIRO(45)DEC3EN2ONE
ZINC67172377
CC1CCC2(CC1)NC(=O)C(=N2)C3=CC=CC=C3
InChI=1SC15H18N2Oc1117915(10811)1613(14(18)1715)125324612h2611H710H21H3(H1718)
BBL003008
Synonyms: 3-(4-fluorophenyl)-1,4-diazaspiro[4.4]non-3-en-2-one
Smiles: O=C1NC2(N=C1c1ccc(cc1)F)CCCC2
O=C1NC2(N=C1c1ccc(cc1)F)CCCC2
ZINC4890623
3(4FLUOROPHENYL)14DIAZASPIRO(44)NON3EN2ONE
899926751
C1CCC2(C1)NC(=O)C(=N2)C3=CC=C(C=C3)F
InChI=1SC13H13FN2Oc1410539(4610)1112(17)1613(1511)712813h36H1278H2(H1617)
BBL003009
Synonyms: 5-(4-butoxyphenyl)-2,2-dimethyl-2,3-dihydro-4H-imidazole-4-thione
Smiles: CCCCOc1ccc(cc1)C1=NC(NC1=S)(C)C
CCCCOc1ccc(cc1)C1=NC(NC1=S)(C)C
5(4BUTOXYPHENYL)22DIMETHYL23DIHYDRO4HIMIDAZOLE4THIONE
ZINC67172378
4(4butoxyphenyl)22dimethyl1Himidazole5thione
CCCCOC1=CC=C(C=C1)C2=NC(NC2=S)(C)C
InChI=1SC15H20N2OSc1451018128611(7912)1314(19)1715(23)1613h69H4510H213H3(H1719)
BBL003010
Synonyms: 3-(4-butoxyphenyl)-8-methyl-1,4-diazaspiro[4.5]dec-3-ene-2-thione
Smiles: CCCCOc1ccc(cc1)C1=NC2(NC1=S)CCC(CC2)C
CCCCOc1ccc(cc1)C1=NC2(NC1=S)CCC(CC2)C
1325306431
3(4BUTOXYPHENYL)8METHYL14DIAZASPIRO(45)DEC3ENE2THIONE
MFCD19104869
ZINC000067172379
ZINC67172379
CCCCOC1=CC=C(C=C1)C2=NC3(CCC(CC3)C)NC2=S
InChI=1SC19H26N2OSc1341322167515(6816)1718(23)2119(2017)11914(2)101219h5814H34913H212H3(H2123)
BBL003011
Synonyms: 8-tert-butyl-3-(4-methylphenyl)-1,4-diazaspiro[4.5]dec-3-ene-2-thione
Smiles: Cc1ccc(cc1)C1=NC2(NC1=S)CCC(CC2)C(C)(C)C
Cc1ccc(cc1)C1=NC2(NC1=S)CCC(CC2)C(C)(C)C
899912595
8TERTBUTYL3(4METHYLPHENYL)14DIAZASPIRO(45)DEC3ENE2THIONE
ZINC4891247
CC1=CC=C(C=C1)C2=NC3(CCC(CC3)C(C)(C)C)NC2=S
InChI=1SC19H26N2Sc1135714(8613)1617(22)2119(2016)11915(101219)18(23)4h5815H912H214H3(H2122)
BBL003012
Synonyms: 3-(2,4-dichlorophenyl)-8-methyl-1,4-diazaspiro[4.5]dec-3-ene-2-thione
Smiles: CC1CCC2(CC1)NC(=S)C(=N2)c1ccc(cc1Cl)Cl
CC1CCC2(CC1)NC(=S)C(=N2)c1ccc(cc1Cl)Cl
3(24DICHLOROPHENYL)8METHYL14DIAZASPIRO(45)DEC3ENE2THIONE
899912539
ZINC4891217
CC1CCC2(CC1)NC(=S)C(=N2)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC15H16Cl2N2Sc194615(759)1813(14(20)1915)113210(16)812(11)17h2389H47H21H3(H1920)
BBL003013
Synonyms: 1-{3-[(4-methoxyphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}piperidine-3-carboxylicacid
Smiles: COc1ccc(cc1)S(=O)(=O)c1nnn2c1nc(N1CCCC(C1)C(=O)O)c1c2ccs1
COc1ccc(cc1)S(=O)(=O)c1nnn2c1nc(N1CCCC(C1)C(=O)O)c1c2ccs1
1(3((4METHOXYPHENYL)SULFONYL)THIENO(23E)(123)TRIAZOLO(15A)PYRIMIDIN5YL)PIPERIDINE3CARBOXYLICACID
BBL003014
Synonyms: tert-butyl(1-{[1-(4-chlorophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}piperidin-4-yl)carbamate
Smiles: O=C(c1nnn(c1)c1ccc(cc1)Cl)N1CCC(CC1)NC(=O)OC(C)(C)C
O=C(c1nnn(c1)c1ccc(cc1)Cl)N1CCC(CC1)NC(=O)OC(C)(C)C
TERTBUTYL(1((1(4CHLOROPHENYL)1H123TRIAZOL4YL)CARBONYL)PIPERIDIN4YL)CARBAMATE
1261014894
ZINC57509237
tertbutylN(1(1(4chlorophenyl)triazole4carbonyl)piperidin4yl)carbamate
CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C2=CN(N=N2)C3=CC=C(C=C3)Cl
InChI=1SC19H24ClN5O3c119(23)2818(27)211481024(11914)17(26)161225(232216)156413(20)5715h471214H811H213H3(H2127)
BBL003015
Synonyms: ethyl4-(3-bromo-4-fluorophenyl)-6-(chloromethyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(CCl)NC(=O)NC1c1ccc(c(c1)Br)F
CCOC(=O)C1=C(CCl)NC(=O)NC1c1ccc(c(c1)Br)F
ethyl4(3bromo4fluorophenyl)6(chloromethyl)2oxo1234tetrahydropyrimidine5carboxylate
1260624778
ethyl4(3bromo4fluorophenyl)6(chloromethyl)2oxo34dihydro1Hpyrimidine5carboxylate
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)F)Br)CCl
InChI=1SC14H13BrClFN2O3c122213(20)1110(616)1814(21)1912(11)7349(17)8(15)57h3512H26H21H3(H2181921)
BBL003016
Synonyms: 5-(4-bromophenyl)-2,2-dimethyl-2,3-dihydro-4H-imidazole-4-thione
Smiles: S=C1NC(N=C1c1ccc(cc1)Br)(C)C
S=C1NC(N=C1c1ccc(cc1)Br)(C)C
ZINC4891062
5(4BROMOPHENYL)22DIMETHYL23DIHYDRO4HIMIDAZOLE4THIONE
899936028
4(4bromophenyl)22dimethyl1Himidazole5thione
CC1(NC(=S)C(=N1)C2=CC=C(C=C2)Br)C
InChI=1SC11H11BrN2Sc111(2)139(10(15)1411)7358(12)647h36H12H3(H1415)
BBL003017
Synonyms: 1-ethyl-6-(furan-2-ylmethyl)-3-methyl-5-thioxo-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Smiles: CCn1nc(c2c1c(=O)n(Cc1ccco1)c(=S)[nH]2)C
CCn1nc(c2c1c(=O)n(Cc1ccco1)c(=S)(nH)2)C
1ethyl6(furan2ylmethyl)3methyl5thioxo1456tetrahydro7Hpyrazolo(43d)pyrimidin7one
1031967799
ZINC100021131
1ethyl6(furan2ylmethyl)3methyl5sulfanylidene4Hpyrazolo(43d)pyrimidin7one
CCN1C2=C(C(=N1)C)NC(=S)N(C2=O)CC3=CC=CO3
InChI=1SC13H14N4O2Sc13171110(8(2)1517)1413(20)16(12(11)18)79546199h46H37H212H3(H1420)
BBL003018
Synonyms: 3-[(4-tert-butylphenyl)sulfonyl]-5-chloro[1,2,3]triazolo[1,5-a]quinazoline
Smiles: Clc1nc2n(c3c1cccc3)nnc2S(=O)(=O)c1ccc(cc1)C(C)(C)C
Clc1nc2n(c3c1cccc3)nnc2S(=O)(=O)c1ccc(cc1)C(C)(C)C
ZINC57508956
1174392461
3((4TERTBUTYLPHENYL)SULFONYL)5CHLORO(123)TRIAZOLO(15A)QUINAZOLINE
3(4tertbutylphenyl)sulfonyl5chlorotriazolo(15a)quinazoline
CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=CC=CC=C4N3N=N2)Cl
InChI=1SC19H17ClN4O2Sc119(23)1281013(11912)27(2526)18172116(20)14645715(14)24(17)232218h411H13H3
BBL003019
Synonyms: 3-(4-butoxyphenyl)-1,4-diazaspiro[4.4]non-3-ene-2-thione
Smiles: CCCCOc1ccc(cc1)C1=NC2(NC1=S)CCCC2
CCCCOc1ccc(cc1)C1=NC2(NC1=S)CCCC2
3(4BUTOXYPHENYL)14DIAZASPIRO(44)NON3ENE2THIONE
ZINC67172382
CCCCOC1=CC=C(C=C1)C2=NC3(CCCC3)NC2=S
InChI=1SC17H22N2OSc1231220148613(7914)1516(21)1917(1815)10451117h69H251012H21H3(H1921)
BBL003020
Synonyms: 5-{[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl}-2-(4-methylphenyl)pyrazolo[1,5-a]pyrazin-4(5H)-one
Smiles: ClCc1onc(n1)Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)C
ClCc1onc(n1)Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)C
ZINC57509279
1260953545
5((5(CHLOROMETHYL)124OXADIAZOL3YL)METHYL)2(4METHYLPHENYL)PYRAZOLO(15A)PYRAZIN4(5H)ONE
5((5(chloromethyl)124oxadiazol3yl)methyl)2(4methylphenyl)pyrazolo(15a)pyrazin4one
CC1=CC=C(C=C1)C2=NN3C=CN(C(=O)C3=C2)CC4=NOC(=N4)CCl
InChI=1SC17H14ClN5O2c1112412(5311)1381417(24)22(6723(14)2013)10151916(918)252115h28H910H21H3
BBL003021
Synonyms: 5-{[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl}-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4(5H)-one
Smiles: COc1ccc(cc1)c1nn2c(c1)c(=O)n(cc2)Cc1noc(n1)CCl
COc1ccc(cc1)c1nn2c(c1)c(=O)n(cc2)Cc1noc(n1)CCl
ZINC57509277
1261016254
5((5(CHLOROMETHYL)124OXADIAZOL3YL)METHYL)2(4METHOXYPHENYL)PYRAZOLO(15A)PYRAZIN4(5H)ONE
5((5(chloromethyl)124oxadiazol3yl)methyl)2(4methoxyphenyl)pyrazolo(15a)pyrazin4one
COC1=CC=C(C=C1)C2=NN3C=CN(C(=O)C3=C2)CC4=NOC(=N4)CCl
InChI=1SC17H14ClN5O3c125124211(3512)1381417(24)22(6723(14)2013)10151916(918)262115h28H910H21H3
BBL003022
Synonyms: tert-butyl(1-{[1-(4-fluoro-3-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}piperidin-4-yl)carbamate
Smiles: O=C(OC(C)(C)C)NC1CCN(CC1)C(=O)c1nnn(c1)c1ccc(c(c1)C)F
O=C(OC(C)(C)C)NC1CCN(CC1)C(=O)c1nnn(c1)c1ccc(c(c1)C)F
TERTBUTYL(1((1(4FLUORO3METHYLPHENYL)1H123TRIAZOL4YL)CARBONYL)PIPERIDIN4YL)CARBAMATE
1260914553
MFCD18201596
ZINC57509229
tertbutylN(1(1(4fluoro3methylphenyl)triazole4carbonyl)piperidin4yl)carbamate
CC1=C(C=CC(=C1)N2C=C(N=N2)C(=O)N3CCC(CC3)NC(=O)OC(C)(C)C)F
InChI=1SC20H26FN5O3c1131115(5616(13)21)261217(232426)18(27)259714(81025)2219(28)2920(23)4h56111214H710H214H3(H2228)
BBL003023
Synonyms: tert-butyl(1-{[1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}piperidin-4-yl)carbamate
Smiles: O=C(c1nnn(c1)c1ccc(cc1)F)N1CCC(CC1)NC(=O)OC(C)(C)C
O=C(c1nnn(c1)c1ccc(cc1)F)N1CCC(CC1)NC(=O)OC(C)(C)C
TERTBUTYL(1((1(4FLUOROPHENYL)1H123TRIAZOL4YL)CARBONYL)PIPERIDIN4YL)CARBAMATE
1261005713
ZINC57509227
tertbutylN(1(1(4fluorophenyl)triazole4carbonyl)piperidin4yl)carbamate
CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C2=CN(N=N2)C3=CC=C(C=C3)F
InChI=1SC19H24FN5O3c119(23)2818(27)211481024(11914)17(26)161225(232216)156413(20)5715h471214H811H213H3(H2127)
BBL003024
Synonyms: methyl6-(chloromethyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: COc1ccc(cc1)C1NC(=O)NC(=C1C(=O)OC)CCl
COc1ccc(cc1)C1NC(=O)NC(=C1C(=O)OC)CCl
methyl6(chloromethyl)4(4methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
1260904424
methyl6(chloromethyl)4(4methoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
COC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CCl)C(=O)OC
InChI=1SC14H15ClN2O4c1209538(469)1211(13(18)212)10(715)1614(19)1712h3612H7H212H3(H2161719)
BBL003025
Synonyms: 3-phenyl-1,4-diazaspiro[4.4]non-3-en-2-one
Smiles: O=C1NC2(N=C1c1ccccc1)CCCC2
O=C1NC2(N=C1c1ccccc1)CCCC2
ZINC4890521
3PHENYL14DIAZASPIRO(44)NON3EN2ONE
899926217
8PHENYL69DIAZASPIRO(44)NON8EN7ONE
C1CCC2(C1)NC(=O)C(=N2)C3=CC=CC=C3
InChI=1SC13H14N2Oc161211(106213710)1413(1512)845913h1367H4589H2(H1516)
BBL003026
Synonyms: 3-[(4-chlorophenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)S(=O)(=O)c1nnn2c1[nH]c(=O)c1c2ccs1
Clc1ccc(cc1)S(=O)(=O)c1nnn2c1(nH)c(=O)c1c2ccs1
3((4chlorophenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidin5(4H)one
BBL003027
Synonyms: 1-ethyl-3-methyl-6-(4-methylbenzyl)-5-thioxo-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Smiles: CCn1nc(c2c1c(=O)n(c(=S)[nH]2)Cc1ccc(cc1)C)C
CCn1nc(c2c1c(=O)n(c(=S)(nH)2)Cc1ccc(cc1)C)C
1ethyl3methyl6(4methylbenzyl)5thioxo1456tetrahydro7Hpyrazolo(43d)pyrimidin7one
1313814695
ZINC101375030
1ethyl3methyl6((4methylphenyl)methyl)5sulfanylidene4Hpyrazolo(43d)pyrimidin7one
CCN1C2=C(C(=N1)C)NC(=S)N(C2=O)CC3=CC=C(C=C3)C
InChI=1SC16H18N4OSc14201413(11(3)1820)1716(22)19(15(14)21)9127510(2)6812h58H49H213H3(H1722)
BBL003028
Synonyms: 2-imino-N-(6-methylpyridin-2-yl)-2H-chromene-3-carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1cc2ccccc2oc1=N
Cc1cccc(n1)NC(=O)c1cc2ccccc2oc1=N
2iminoN(6methylpyridin2yl)2Hchromene3carboxamide
BBL003029
Synonyms: 2-imino-8-methoxy-N-(6-methylpyridin-2-yl)-2H-chromene-3-carboxamide
Smiles: COc1cccc2c1oc(=N)c(c2)C(=O)Nc1cccc(n1)C
COc1cccc2c1oc(=N)c(c2)C(=O)Nc1cccc(n1)C
2imino8methoxyN(6methylpyridin2yl)2Hchromene3carboxamide
BBL003030
Synonyms: methyl6-(chloromethyl)-4-(4-hydroxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: COC(=O)C1=C(CCl)NC(=O)NC1c1ccc(cc1)O
COC(=O)C1=C(CCl)NC(=O)NC1c1ccc(cc1)O
methyl6(chloromethyl)4(4hydroxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
1260991205
methyl6(chloromethyl)4(4hydroxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
COC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)O)CCl
InChI=1SC13H13ClN2O4c12012(18)109(614)1513(19)1611(10)7248(17)537h251117H6H21H3(H2151619)
BBL003031
Synonyms: N-(furan-2-ylmethyl)-2-imino-8-methoxy-2H-chromene-3-carboxamide
Smiles: COc1cccc2c1oc(=N)c(c2)C(=O)NCc1ccco1
N(furan2ylmethyl)2imino8methoxy2Hchromene3carboxamide
BBL003032
Synonyms: 3-(3,5-dimethoxyphenyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione
Smiles: COc1cc(cc(c1)OC)C1=NC2(NC1=S)CCCCCC2
COc1cc(cc(c1)OC)C1=NC2(NC1=S)CCCCCC2
3(35DIMETHOXYPHENYL)14DIAZASPIRO(46)UNDEC3ENE2THIONE
899936471
ZINC4891194
COC1=CC(=CC(=C1)C2=NC3(CCCCCC3)NC2=S)OC
InChI=1SC17H22N2O2Sc12013912(1014(1113)212)1516(22)1917(1815)75346817h911H38H212H3(H1922)
BBL003033
Synonyms: 3-benzyl-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
Smiles: S=c1[nH]c2ccccc2c(=O)n1Cc1ccccc1
S=c1(nH)c2ccccc2c(=O)n1Cc1ccccc1
ZINC98174789
13906053
2THIOXO3BENZYL12DIHYDROQUINAZOLINE4(3H)ONE
3BENZYL2MERCAPTO3HQUINAZOLIN4ONE
3BENZYL2MERCAPTOQUINAZOLIN4(3H)ONE
3BENZYL2SULFANYL34DIHYDROQUINAZOLIN4ONE
3BENZYL2SULFANYL3HYDROQUINAZOLIN4ONE
3BENZYL2SULFANYLIDENE1HQUINAZOLIN4ONE
3BENZYL2SULFANYLQUINAZOLIN4(3H)ONE
3BENZYL2THIOXO13DIHYDROQUINAZOLIN4ONE
3BENZYL2THIOXO23DIHYDRO1HQUINAZOLIN4ONE
3BENZYL2THIOXO23DIHYDRO4(1H)QUINAZOLINONE
3BENZYL2THIOXO23DIHYDROQUINAZOLIN4(1H)ONE
4(1H)QUINAZOLINONE23DIHYDRO3(PHENYLMETHYL)2THIOXO
BENZYLTHIOXODIHYDROQUINAZOLINONE
C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3NC2=S
InChI=1SC15H12N2OSc181412845913(12)1615(19)17(14)10116213711h19H10H2(H1619)
BBL003034
Synonyms: 5-methyl-4-oxo-3-[2-oxo-2-(pyridin-2-ylamino)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylicacid
Smiles: O=C(Cn1cnc2c(c1=O)c(C)c(s2)C(=O)O)Nc1ccccn1
O=C(Cn1cnc2c(c1=O)c(C)c(s2)C(=O)O)Nc1ccccn1
ZINC31848662
1119451158
5METHYL4OXO3(((PYRIDIN2YL)CARBAMOYL)METHYL)THIENO(23D)PYRIMIDINE6CARBOXYLICACID
5METHYL4OXO3(2OXO2(PYRIDIN2YLAMINO)ETHYL)34DIHYDROTHIENO(23D)PYRIMIDINE6CARBOXYLICACID
5methyl4oxo3(2oxo2(pyridin2ylamino)ethyl)thieno(23d)pyrimidine6carboxylicacid
CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=CC=N3)C(=O)O
InChI=1SC15H12N4O4Sc181113(2412(8)15(22)23)17719(14(11)21)610(20)1894235169h257H6H21H3(H2223)(H161820)
BBL003035
Synonyms: 6-(2-fluorophenyl)pyridazin-3(2H)-one
Smiles: Fc1ccccc1c1ccc(=O)[nH]n1
Fc1ccccc1c1ccc(=O)(nH)n1
ZINC13998706
6(2FLUOROPHENYL)23DIHYDROPYRIDAZIN3ONE
6(2FLUOROPHENYL)2HPYRIDAZIN3ONE
6(2FLUOROPHENYL)PYRIDAZIN3(2H)ONE
6(2FLUOROPHENYL)PYRIDAZIN3OL
66549620
3(2fluorophenyl)1Hpyridazin6one
C1=CC=C(C(=C1)C2=NNC(=O)C=C2)F
InChI=1SC10H7FN2Oc11842137(8)95610(14)13129h16H(H1314)
BBL003036
Synonyms: 5-amino-1-(4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: NC(=O)c1nnn(c1N)c1ccc(cc1)C
NC(=O)c1nnn(c1N)c1ccc(cc1)C
ZINC04984863
ZINC4984863
1(4METHYLPHENYL)5AMINO1H123TRIAZOLE4CARBOXAMIDE
5AMINO1(4METHYLPHENYL)123TRIAZOLE4CARBOXAMIDE
5AMINO1(4METHYLPHENYL)1H123TRIAZOLE4CARBOXAMIDE
5AMINO1(4METHYLPHENYL)TRIAZOLE4CARBOXAMIDE
5AMINO1PTOLYL1H(123)TRIAZOLE4CARBOXYLICACIDAMIDE
71924997
CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)N)N
InChI=1SC10H11N5Oc16247(536)159(11)8(10(12)16)131415h25H11H21H3(H21216)
BBL003037
Synonyms: 6-(4-chlorophenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Clc1ccc(cc1)c1cc(=O)[nH]c(=S)[nH]1
Clc1ccc(cc1)c1cc(=O)(nH)c(=S)(nH)1
ZINC16972267
36479171
4(1H)PYRIMIDINONE6(4CHLOROPHENYL)23DIHYDRO2THIOXO
6(4CHLOROPHENYL)23DIHYDRO2THIOXO4(1H)PYRIMIDINONE
6(4CHLOROPHENYL)2SULFANYLIDENE13DIHYDROPYRIMIDIN4ONE
6(4CHLOROPHENYL)2THIOXO23DIHYDRO1HPYRIMIDIN4ONE
6(4CHLOROPHENYL)2THIOXO23DIHYDROPYRIMIDIN4(1(H))ONE
6(4CHLOROPHENYL)2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
BBL003038
Synonyms: 6-(pyridin-4-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: O=c1cc([nH]c(=S)[nH]1)c1ccncc1
O=c1cc((nH)c(=S)(nH)1)c1ccncc1
ZINC26420766
2MERCAPTO6(4PYRIDYL)4PYRIMIDOL
37039717
6(4PYRIDYL)2SULFANYLPYRIMIDIN4OL
6(PYRIDIN4YL)2SULFANYLIDENE13DIHYDROPYRIMIDIN4ONE
6(PYRIDIN4YL)2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
6PYRIDIN4YL2SULFANYLIDENE1HPYRIMIDIN4ONE
6PYRIDIN4YL2THIOXO23DIHYDRO1HPYRIMIDIN4ONE
6PYRIDIN4YL2THIOXO23DIHYDROPYRIMIDIN4(1(H))ONE
C1=CN=CC=C1C2=CC(=O)NC(=S)N2
InChI=1SC9H7N3OSc13857(119(14)128)61310426h15H(H211121314)
BBL003039
Synonyms: 1-(3-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylicacid
Smiles: Clc1cccc(c1)n1nnc(c1C)C(=O)O
Clc1cccc(c1)n1nnc(c1C)C(=O)O
ZINC365913
1(3CHLOROPHENYL)5METHYL123TRIAZOLE4CARBOXYLICACID
1(3CHLOROPHENYL)5METHYL1H(123)TRIAZOLE4CARBOXYLICACID
1(3CHLOROPHENYL)5METHYL1H123TRIAZOLE4CARBOXYLICACID
1(3CHLOROPHENYL)5METHYLTRIAZOLE4CARBOXYLICACID
1H123TRIAZOLE4CARBOXYLICACID1(3CHLOROPHENYL)5METHYL
88958149
CC1=C(N=NN1C2=CC(=CC=C2)Cl)C(=O)O
InChI=1SC10H8ClN3O2c169(10(15)16)121314(6)84237(11)58h25H1H3(H1516)
BBL003040
Synonyms: 6-(4-ethylphenyl)pyridazin-3(2H)-one
Smiles: CCc1ccc(cc1)c1ccc(=O)[nH]n1
CCc1ccc(cc1)c1ccc(=O)(nH)n1
ZINC00389315
ZINC389315
3(2H)PYRIDAZINONE6(4ETHYLPHENYL)
3(4ETHYLPHENYL)1HPYRIDAZIN6ONE
55901967
6(4ETHYLPHENYL)2HPYRIDAZIN3ONE
6(4ETHYLPHENYL)PYRIDAZIN3(2H)ONE
6(4ETHYLPHENYL)PYRIDAZIN3OL
CCC1=CC=C(C=C1)C2=NNC(=O)C=C2
InChI=1SC12H12N2Oc1293510(649)117812(15)141311h38H2H21H3(H1415)
BBL003041
Synonyms: 1-(3-chlorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: Clc1cccc(c1)n1nnc(c1c1cccnc1)C(=O)O
Clc1cccc(c1)n1nnc(c1c1cccnc1)C(=O)O
1223890730
1(3CHLOROPHENYL)5(PYRIDIN3YL)1H123TRIAZOLE4CARBOXYLICACID
1(3CHLOROPHENYL)5PYRIDIN3YL1H(123)TRIAZOLE4CARBOXYLICACID
1(3CHLOROPHENYL)5PYRIDIN3YL1H123TRIAZOLE4CARBOXYLICACID
ZINC40478847
1(3chlorophenyl)5pyridin3yltriazole4carboxylicacid
C1=CC(=CC(=C1)Cl)N2C(=C(N=N2)C(=O)O)C3=CN=CC=C3
InChI=1SC14H9ClN4O2c151041511(710)1913(93261689)12(14(20)21)171819h18H(H2021)
BBL003042
Synonyms: 9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one
Smiles: COc1ccc(cc1)c1nn2c(c1)c1n[nH]c(=O)n1cc2
COc1ccc(cc1)c1nn2c(c1)c1n(nH)c(=O)n1cc2
1030089634
9(4METHOXYPHENYL)PYRAZOLO(15A)(124)TRIAZOLO(34C)PYRAZIN3(2H)ONE
COC1=CC=C(C=C1)C2=NN3C=CN4C(=NNC4=O)C3=C2
InChI=1SC14H11N5O2c12110429(3510)1181213151614(20)18(13)6719(12)1711h28H1H3(H1620)
BBL003043
Synonyms: 3-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)propanoicacid
Smiles: OC(=O)CCn1ccn2c(c1=O)cc(n2)c1ccccc1
OC(=O)CCn1ccn2c(c1=O)cc(n2)c1ccccc1
ZINC57352149
3(4OXO2PHENYLPYRAZOLO(15A)PYRAZIN5(4H)YL)PROPANOICACID
BBL003044
Synonyms: 3-[2-(3-chlorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]propanoicacid
Smiles: OC(=O)CCn1ccn2c(c1=O)cc(n2)c1cccc(c1)Cl
OC(=O)CCn1ccn2c(c1=O)cc(n2)c1cccc(c1)Cl
ZINC57352147
1255777571
3(2(3CHLOROPHENYL)4OXOPYRAZOLO(15A)PYRAZIN5(4H)YL)PROPANOICACID
3(2(3chlorophenyl)4oxopyrazolo(15a)pyrazin5yl)propanoicacid
C1=CC(=CC(=C1)Cl)C2=NN3C=CN(C(=O)C3=C2)CCC(=O)O
InChI=1SC15H12ClN3O3c161131210(811)1291315(22)18(5414(20)21)6719(13)1712h1369H45H2(H2021)
BBL003045
Synonyms: 3-[2-(4-chlorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]propanoicacid
Smiles: OC(=O)CCn1ccn2c(c1=O)cc(n2)c1ccc(cc1)Cl
OC(=O)CCn1ccn2c(c1=O)cc(n2)c1ccc(cc1)Cl
ZINC57352145
1255784383
3(2(4CHLOROPHENYL)4OXOPYRAZOLO(15A)PYRAZIN5(4H)YL)PROPANOICACID
3(2(4chlorophenyl)4oxopyrazolo(15a)pyrazin5yl)propanoicacid
C1=CC(=CC=C1C2=NN3C=CN(C(=O)C3=C2)CCC(=O)O)Cl
InChI=1SC15H12ClN3O3c16113110(2411)1291315(22)18(6514(20)21)7819(13)1712h1479H56H2(H2021)
BBL003046
Synonyms: methyl1,5-dimethyl-3-[(methylsulfonyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1c(NS(=O)(=O)C)c2c(n1C)ccc(c2)C
COC(=O)c1c(NS(=O)(=O)C)c2c(n1C)ccc(c2)C
1255785160
METHYL15DIMETHYL3((METHYLSULFONYL)AMINO)1HINDOLE2CARBOXYLATE
ZINC57352143
methyl3(methanesulfonamido)15dimethylindole2carboxylate
CC1=CC2=C(C=C1)N(C(=C2NS(=O)(=O)C)C(=O)OC)C
InChI=1SC13H16N2O4Sc1856109(78)11(1420(417)18)12(15(10)2)13(16)193h5714H14H3
BBL003047
Synonyms: [1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one
Smiles: O=c1[nH]c2cnnn2c2c1cccc2
O=c1(nH)c2cnnn2c2c1cccc2
(123)triazolo(15a)quinazolin5(4H)one
896372682
BBL003048
Synonyms: 1-[2-(3,4-dimethylphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1nccn2c1cc(n2)c1ccc(c(c1)C)C
OC(=O)C1CCN(CC1)c1nccn2c1cc(n2)c1ccc(c(c1)C)C
ZINC33267961
1(2(34DIMETHYLPHENYL)PYRAZOLO(15A)PYRAZIN4YL)PIPERIDINE4CARBOXYLICACID
CC1=C(C=C(C=C1)C2=NN3C=CN=C(C3=C2)N4CCC(CC4)C(=O)O)C
InChI=1SC20H22N4O2c1133416(1114(13)2)17121819(2171024(18)2217)238515(6923)20(25)26h347101215H5689H212H3(H2526)
BBL003049
Synonyms: 3-[(4-methylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5(4H)-one
Smiles: Cc1ccc(cc1)S(=O)(=O)c1nnn2c1[nH]c(=O)c1c2ccs1
Cc1ccc(cc1)S(=O)(=O)c1nnn2c1(nH)c(=O)c1c2ccs1
3((4methylphenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidin5(4H)one
BBL003050
Synonyms: (1Z)-2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]-N'-hydroxyethanimidamide
Smiles: O/N=C(/Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)F)\N
ON=C(Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)F)N
ZINC57352224
(1Z)2(2(4FLUOROPHENYL)4OXOPYRAZOLO(15A)PYRAZIN5(4H)YL)NHYDROXYETHANIMIDAMIDE
(Z)2(2(4FLUOROPHENYL)4OXO4H5HPYRAZOLO(15A)PYRAZIN5YL)NHYDROXYETHENIMIDAMIDE
1255791173
2(2(4FLUOROPHENYL)4OXOPYRAZOLO(15A)PYRAZIN5(4H)YL)NHYDROXYACETIMIDAMIDE
2(2(4fluorophenyl)4oxopyrazolo(15a)pyrazin5yl)Nhydroxyethanimidamide
C1=CC(=CC=C1C2=NN3C=CN(C(=O)C3=C2)CC(=NO)N)F
InChI=1SC14H12FN5O2c1510319(2410)1171214(21)19(813(16)1822)5620(12)1711h1722H8H2(H21618)
BBL003051
Synonyms: (1Z)-N'-hydroxy-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)ethanimidamide
Smiles: O/N=C(/Cn1ccn2c(c1=O)cc(n2)c1ccccc1)\N
ON=C(Cn1ccn2c(c1=O)cc(n2)c1ccccc1)N
ZINC57352220
(1Z)NHYDROXY2(4OXO2PHENYLPYRAZOLO(15A)PYRAZIN5(4H)YL)ETHANIMIDAMIDE
1255790965
Nhydroxy2(4oxo2phenylpyrazolo(15a)pyrazin5yl)ethanimidamide
C1=CC=C(C=C1)C2=NN3C=CN(C(=O)C3=C2)CC(=NO)N
InChI=1SC14H13N5O2c1513(1721)918671912(14(18)20)811(1619)104213510h1821H9H2(H21517)
BBL003052
Synonyms: (1Z)-N'-hydroxy-2-[2-(4-methylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethanimidamide
Smiles: O/N=C(/Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)C)\N
ON=C(Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)C)N
ZINC57352219
(1Z)NHYDROXY2(2(4METHYLPHENYL)4OXOPYRAZOLO(15A)PYRAZIN5(4H)YL)ETHANIMIDAMIDE
1255791151
Nhydroxy2(2(4methylphenyl)4oxopyrazolo(15a)pyrazin5yl)ethanimidamide
CC1=CC=C(C=C1)C2=NN3C=CN(C(=O)C3=C2)CC(=NO)N
InChI=1SC15H15N5O2c1102411(5310)1281315(21)19(914(16)1822)6720(13)1712h2822H9H21H3(H21618)
BBL003053
Synonyms: 8-chloro[1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one
Smiles: Clc1ccc2c(c1)n1nncc1[nH]c2=O
Clc1ccc2c(c1)n1nncc1(nH)c2=O
8chloro(123)triazolo(15a)quinazolin5(4H)one
BBL003054
Synonyms: (1Z)-N'-hydroxy-2-[2-(4-methoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]ethanimidamide
Smiles: O/N=C(/Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)OC)\N
ON=C(Cn1ccn2c(c1=O)cc(n2)c1ccc(cc1)OC)N
ZINC000057352226
ZINC57352226
MFCD17780266
(1Z)NHYDROXY2(2(4METHOXYPHENYL)4OXOPYRAZOLO(15A)PYRAZIN5(4H)YL)ETHANIMIDAMIDE
1255790874
Nhydroxy2(2(4methoxyphenyl)4oxopyrazolo(15a)pyrazin5yl)ethanimidamide
COC1=CC=C(C=C1)C2=NN3C=CN(C(=O)C3=C2)CC(=NO)N
InChI=1SC15H15N5O3c123114210(3511)1281315(21)19(914(16)1822)6720(13)1712h2822H9H21H3(H21618)
BBL003055
Synonyms: (1Z)-N'-hydroxy-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrazin-5(4H)-yl]ethanimidamide
Smiles: O/N=C(/Cn1ccn2c(c1=O)cc(n2)c1cccs1)\N
ON=C(Cn1ccn2c(c1=O)cc(n2)c1cccs1)N
ZINC000057352223
ZINC57352223
MFCD17780264
NHYDROXY2(4OXO2(THIOPHEN2YL)PYRAZOLO(15A)PYRAZIN5(4H)YL)ACETIMIDAMIDE
(1Z)NHYDROXY2(4OXO2(2THIENYL)PYRAZOLO(15A)PYRAZIN5(4H)YL)ETHANIMIDAMIDE
(1Z)NHYDROXY2(4OXO2(THIOPHEN2YL)PYRAZOLO(15A)PYRAZIN5(4H)YL)ETHANIMIDAMIDE
(Z)NHYDROXY2(4OXO2(THIOPHEN2YL)4H5HPYRAZOLO(15A)PYRAZIN5YL)ETHENIMIDAMIDE
1255791128
Nhydroxy2(4oxo2thiophen2ylpyrazolo(15a)pyrazin5yl)ethanimidamide
C1=CSC(=C1)C2=NN3C=CN(C(=O)C3=C2)CC(=NO)N
InChI=1SC12H11N5O2Sc1311(1519)71634179(12(16)18)68(1417)102152010h1619H7H2(H21315)
BBL003056
Synonyms: 5-{[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl}-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrazin-4(5H)-one
Smiles: ClCc1onc(n1)Cn1ccn2c(c1=O)cc(n2)c1cccs1
ClCc1onc(n1)Cn1ccn2c(c1=O)cc(n2)c1cccs1
ZINC57352216
1255788761
5((5(CHLOROMETHYL)124OXADIAZOL3YL)METHYL)2(THIOPHEN2YL)PYRAZOLO(15A)PYRAZIN4(5H)ONE
5((5(chloromethyl)124oxadiazol3yl)methyl)2thiophen2ylpyrazolo(15a)pyrazin4one
C1=CSC(=C1)C2=NN3C=CN(C(=O)C3=C2)CC4=NOC(=N4)CCl
InChI=1SC14H10ClN5O2Sc157131612(182213)819342010(14(19)21)69(1720)112152311h16H78H2
BBL003057
Synonyms: 1-(4-fluorobenzyl)-1H-2,1-benzothiazin-4(3H)-one2,2-dioxide
Smiles: Fc1ccc(cc1)CN1c2ccccc2C(=O)CS1(=O)=O
Fc1ccc(cc1)CN1c2ccccc2C(=O)CS1(=O)=O
1(4FLUOROBENZYL)1H21BENZOTHIAZIN4(3H)ONE22DIOXIDE
1255783302
ZINC57352139
1((4fluorophenyl)methyl)22dioxo2$l^(6)1benzothiazin4one
C1C(=O)C2=CC=CC=C2N(S1(=O)=O)CC3=CC=C(C=C3)F
InChI=1SC15H12FNO3Sc16127511(6812)91714421313(14)15(18)1021(1719)20h18H910H2
BBL003058
Synonyms: 1-benzyl-N'-hydroxy-5-methyl-1H-1,2,3-triazole-4-carboximidamide
Smiles: O/N=C(/c1nnn(c1C)Cc1ccccc1)\N
ON=C(c1nnn(c1C)Cc1ccccc1)N
1benzylNhydroxy5methyl1H123triazole4carboximidamide
1255790841
BBL003059
Synonyms: 1-(4-fluorophenyl)-N'-hydroxy-5-methyl-1H-1,2,3-triazole-4-carboximidamide
Smiles: O/N=C(/c1nnn(c1C)c1ccc(cc1)F)\N
ON=C(c1nnn(c1C)c1ccc(cc1)F)N
1(4fluorophenyl)Nhydroxy5methyl1H123triazole4carboximidamide
1255790932
BBL003060
Synonyms: 5-amino-1-(5-chloro-2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: COc1ccc(cc1n1nnc(c1N)C(=O)N)Cl
COc1ccc(cc1n1nnc(c1N)C(=O)N)Cl
ZINC57352102
1255777617
5AMINO1(5CHLORO2METHOXYPHENYL)1H123TRIAZOLE4CARBOXAMIDE
5amino1(5chloro2methoxyphenyl)triazole4carboxamide
COC1=C(C=C(C=C1)Cl)N2C(=C(N=N2)C(=O)N)N
InChI=1SC10H10ClN5O2c1187325(11)46(7)169(12)8(10(13)17)141516h24H12H21H3(H21317)
BBL003061
Synonyms: 1-[4-(propan-2-yl)phenyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: CC(c1ccc(cc1)n1nnc(c1n1cccc1)C(=O)O)C
CC(c1ccc(cc1)n1nnc(c1n1cccc1)C(=O)O)C
ZINC57352051
1(4(PROPAN2YL)PHENYL)5(1HPYRROL1YL)1H123TRIAZOLE4CARBOXYLICACID
1(4ISOPROPYLPHENYL)5(1HPYRROL1YL)1H123TRIAZOLE4CARBOXYLICACID
1255782730
1(4propan2ylphenyl)5pyrrol1yltriazole4carboxylicacid
CC(C)C1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)N3C=CC=C3
InChI=1SC16H16N4O2c111(2)125713(8612)2015(199341019)14(16(21)22)171820h311H12H3(H2122)
BBL003062
Synonyms: 1-(4-fluorobenzyl)-1H-thieno[3,2-c][1,2]thiazin-4(3H)-one2,2-dioxide
Smiles: Fc1ccc(cc1)CN1c2ccsc2C(=O)CS1(=O)=O
Fc1ccc(cc1)CN1c2ccsc2C(=O)CS1(=O)=O
ZINC21365332
1(4FLUOROBENZYL)1HTHIENO(32C)(12)THIAZIN4(3H)ONE22DIOXIDE
BBL003063
Synonyms: 5-amino-N-(5-chloro-2-methylphenyl)-1-phenyl-1H-1,2,3-triazole-4-carboxamide
Smiles: Clc1ccc(c(c1)NC(=O)c1nnn(c1N)c1ccccc1)C
Clc1ccc(c(c1)NC(=O)c1nnn(c1N)c1ccccc1)C
ZINC10273017
5AMINON(5CHLORO2METHYLPHENYL)1PHENYL1H123TRIAZOLE4CARBOXAMIDE
899725634
5aminoN(5chloro2methylphenyl)1phenyltriazole4carboxamide
CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(N(N=N2)C3=CC=CC=C3)N
InChI=1SC16H14ClN5Oc1107811(17)913(10)1916(23)1415(18)22(212014)125324612h29H18H21H3(H1923)
BBL003064
Synonyms: 1-(4-fluorophenyl)-N'-hydroxy-1H-1,2,3-triazole-4-carboximidamide
Smiles: O/N=C(/c1nnn(c1)c1ccc(cc1)F)\N
ON=C(c1nnn(c1)c1ccc(cc1)F)N
1(4fluorophenyl)Nhydroxy1H123triazole4carboximidamide
1255791093
BBL003065
Synonyms: 5-[(3-chloro-4-methoxyphenyl)sulfonyl]-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: COc1ccc(cc1Cl)S(=O)(=O)c1c[nH]c(=S)[nH]c1=O
COc1ccc(cc1Cl)S(=O)(=O)c1c(nH)c(=S)(nH)c1=O
ZINC12471136
5((3CHLORO4METHOXYPHENYL)SULFONYL)2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
5(3CHLORANYL4METHOXYPHENYL)SULFONYL2SULFANYLIDENE1HPYRIMIDIN4ONE
5(3CHLORO4METHOXYPHENYL)SULFONYL2SULFANYLIDENE1HPYRIMIDIN4ONE
5(3CHLORO4METHOXYPHENYL)SULFONYL2THIOXO1HPYRIMIDIN4ONE
931938362
COC1=C(C=C(C=C1)S(=O)(=O)C2=CNC(=S)NC2=O)Cl
InChI=1SC11H9ClN2O4S2c1188326(47(8)12)20(1617)951311(19)1410(9)15h25H1H3(H213141519)
BBL003066
Synonyms: 1-(4-methylbenzyl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: Cc1ccc(cc1)Cn1nnc(c1)C(=O)O
Cc1ccc(cc1)Cn1nnc(c1)C(=O)O
1(4METHYLBENZYL)1H123TRIAZOLE4CARBOXYLICACID
931703683
ZINC9250491
1((4methylphenyl)methyl)triazole4carboxylicacid
CC1=CC=C(C=C1)CN2C=C(N=N2)C(=O)O
InChI=1SC11H11N3O2c18249(538)614710(11(15)16)121314h257H6H21H3(H1516)
BBL003067
Synonyms: ethyl6-(chloromethyl)-4-(4-hydroxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(CCl)NC(=O)NC1c1ccc(cc1)O
CCOC(=O)C1=C(CCl)NC(=O)NC1c1ccc(cc1)O
ethyl6(chloromethyl)4(4hydroxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6(CHLOROMETHYL)4(4HYDROXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC00166050
262296559
ETHYL4(CHLOROMETHYL)6(4HYDROXYPHENYL)2OXO36DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)O)CCl
InChI=1SC14H15ClN2O4c122113(19)1110(715)1614(20)1712(11)8359(18)648h361218H27H21H3(H2161720)
BBL003068
Synonyms: methyl5-amino-1-[2-oxo-2-(phenylamino)ethyl]-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nnn(c1N)CC(=O)Nc1ccccc1
COC(=O)c1nnn(c1N)CC(=O)Nc1ccccc1
892291917
METHYL5AMINO1(2ANILINO2OXOETHYL)1H123TRIAZOLE4CARBOXYLATE
METHYL5AMINO1(2ANILINO2OXOETHYL)TRIAZOLE4CARBOXYLATE
METHYL5AMINO1(2OXO2(PHENYLAMINO)ETHYL)1H123TRIAZOLE4CARBOXYLATE
ZINC248848
COC(=O)C1=C(N(N=N1)CC(=O)NC2=CC=CC=C2)N
InChI=1SC12H13N5O3c12012(19)1011(13)17(161510)79(18)148532468h26H713H21H3(H1418)
BBL003069
Synonyms: 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylicacid
Smiles: CSc1cccc(c1)n1nnc(c1C)C(=O)O
CSc1cccc(c1)n1nnc(c1C)C(=O)O
933196373
5METHYL1(3(METHYLSULFANYL)PHENYL)1H123TRIAZOLE4CARBOXYLICACID
5METHYL1(3(METHYLTHIO)PHENYL)1H123TRIAZOLE4CARBOXYLICACID
5METHYL1(3METHYLSULFANYLPHENYL)1H(123)TRIAZOLE4CARBOXYLICACID
ZINC16991788
5methyl1(3methylsulfanylphenyl)triazole4carboxylicacid
CC1=C(N=NN1C2=CC(=CC=C2)SC)C(=O)O
InChI=1SC11H11N3O2Sc1710(11(15)16)121314(7)84359(68)172h36H12H3(H1516)
BBL003070
Synonyms: 6-(4-fluorophenyl)pyridazine-3(2H)-thione
Smiles: Fc1ccc(cc1)c1ccc(=S)[nH]n1
Fc1ccc(cc1)c1ccc(=S)(nH)n1
1202742128
6(4FLUOROPHENYL)2HPYRIDAZINE3THIONE
6(4FLUOROPHENYL)PYRIDAZINE3(2H)THIONE
6(4FLUOROPHENYL)PYRIDAZINE3THIOL
ZINC41214510
3(4fluorophenyl)1Hpyridazine6thione
C1=CC(=CC=C1C2=NNC(=S)C=C2)F
InChI=1SC10H7FN2Sc118317(248)95610(14)13129h16H(H1314)
BBL003071
Synonyms: 1-(4-methoxyphenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: COc1ccc(cc1)n1nnc(c1c1cccnc1)C(=O)O
COc1ccc(cc1)n1nnc(c1c1cccnc1)C(=O)O
1031977099
1(4METHOXYPHENYL)5(PYRIDIN3YL)1H123TRIAZOLE4CARBOXYLICACID
1(4METHOXYPHENYL)5PYRIDIN3YL1H(123)TRIAZOLE4CARBOXYLICACID
1(4METHOXYPHENYL)5PYRIDIN3YL1H123TRIAZOLE4CARBOXYLICACID
ZINC21657732
1(4methoxyphenyl)5pyridin3yltriazole4carboxylicacid
COC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)C3=CN=CC=C3
InChI=1SC15H12N4O3c122126411(5712)1914(1032816910)13(15(20)21)171819h29H1H3(H2021)
BBL003072
Synonyms: 1-[2-chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: OC(=O)c1nnn(c1c1cccnc1)c1cc(ccc1Cl)C(F)(F)F
OC(=O)c1nnn(c1c1cccnc1)c1cc(ccc1Cl)C(F)(F)F
ZINC40478849
1(2CHLORO5(TRIFLUOROMETHYL)PHENYL)5(PYRIDIN3YL)1H123TRIAZOLE4CARBOXYLICACID
1(2CHLORO5(TRIFLUOROMETHYL)PHENYL)5PYRIDIN3YL1H123TRIAZOLE4CARBOXYLICACID
1(2CHLORO5TRIFLUOROMETHYLPHENYL)5PYRIDIN3YL1H(123)TRIAZOLE4CARBOXYLICACID
1223888945
1(2chloro5(trifluoromethyl)phenyl)5pyridin3yltriazole4carboxylicacid
C1=CC(=CN=C1)C2=C(N=NN2C3=C(C=CC(=C3)C(F)(F)F)Cl)C(=O)O
InChI=1SC15H8ClF3N4O2c1610439(15(1718)19)611(10)2313(82152078)12(14(24)25)212223h17H(H2425)
BBL003073
Synonyms: N-(4-methylbenzyl)-4-(2-thioxo-2,3-dihydro-1H-imidazol-1-yl)benzamide
Smiles: O=C(c1ccc(cc1)n1cc[nH]c1=S)NCc1ccc(cc1)C
O=C(c1ccc(cc1)n1cc(nH)c1=S)NCc1ccc(cc1)C
ZINC40478817
1223887500
N(4METHYLBENZYL)4(2THIOXO23DIHYDRO1HIMIDAZOL1YL)BENZAMIDE
N(4METHYLBENZYL)4(2THIOXO23DIHYDROIMIDAZOL1YL)BENZAMIDE
N((4methylphenyl)methyl)4(2sulfanylidene1Himidazol3yl)benzamide
CC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C=CNC3=S
InChI=1SC18H17N3OSc1132414(5313)122017(22)156816(9715)2111101918(21)23h211H12H21H3(H1923)(H2022)
BBL003074
Synonyms: 2-thioxo-1,2,3,5,6,7-hexahydro-4H-cyclopenta[d]pyrimidin-4-one
Smiles: O=c1[nH]c(=S)[nH]c2c1CCC2
O=c1(nH)c(=S)(nH)c2c1CCC2
2thioxo123567hexahydro4Hcyclopenta(d)pyrimidin4one
35563270
3SULFANYLIDENE24DIAZABICYCLO(430)NON10EN5ONE
2MERCAPTO67DIHYDRO3HCYCLOPENTA(D)PYRIMIDIN4(5H)ONE
2MERCAPTO67DIHYDRO3HCYCLOPENTAPYRIMIDIN4(5H)ONE
2MERCAPTO67DIHYDRO5HCYCLOPENTA(D)PYRIMIDIN4OL
2SULFANYL3H5H6H7HCYCLOPENTA(D)PYRIMIDIN4ONE
2SULFANYL5H6H7HCYCLOPENTA(D)PYRIMIDIN4OL
2SULFANYL67DIHYDRO5HCYCLOPENTA(D)PYRIMIDIN4OL
SULFANYLDIHYDROCYCLOPENTADPYRIMIDINOL
ZINC18145977
2SULFANYLIDENE1H3H5H6H7HCYCLOPENTA(D)PYRIMIDIN4ONE
2sulfanylidene1567tetrahydrocyclopenta(d)pyrimidin4one
C1CC2=C(C1)NC(=S)NC2=O
InChI=1SC7H8N2OSc10642135(4)87(11)96h13H2(H2891011)
BBL003075
Synonyms: 5-oxo-3-phenyl-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)n1nnc(c1[nH]c2=O)c1ccccc1
OC(=O)c1ccc2c(c1)n1nnc(c1(nH)c2=O)c1ccccc1
5oxo3phenyl45dihydro(123)triazolo(15a)quinazoline8carboxylicacid
MFCD14703498
ZINC000045918712
1239751406
BBL003076
Synonyms: 5-methyl-1-(4-methylphenyl)-1H-1,2,3-triazole-4-carbothioamide
Smiles: NC(=S)c1nnn(c1C)c1ccc(cc1)C
NC(=S)c1nnn(c1C)c1ccc(cc1)C
ZINC45918743
1239739720
5METHYL1(4METHYLPHENYL)1H123TRIAZOLE4CARBOTHIOAMIDE
5METHYL1PTOLYL1H(123)TRIAZOLE4CARBOTHIOICACIDAMIDE
5methyl1(4methylphenyl)triazole4carbothioamide
CC1=CC=C(C=C1)N2C(=C(N=N2)C(=S)N)C
InChI=1SC11H12N4Sc17359(647)158(2)10(11(12)16)131415h36H12H3(H21216)
BBL003077
Synonyms: 3-(4-methoxyphenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxylicacid
Smiles: COc1ccc(cc1)c1nnn2c1[nH]c(=O)c1c2cc(cc1)C(=O)O
COc1ccc(cc1)c1nnn2c1(nH)c(=O)c1c2cc(cc1)C(=O)O
3(4methoxyphenyl)5oxo45dihydro(123)triazolo(15a)quinazoline8carboxylicacid
BBL003078
Synonyms: 6-(3-chlorophenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Clc1cccc(c1)c1cc(=O)[nH]c(=S)[nH]1
Clc1cccc(c1)c1cc(=O)(nH)c(=S)(nH)1
6(3CHLOROPHENYL)2THIOXO23DIHYDRO1HPYRIMIDIN4ONE
6(3CHLOROPHENYL)2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
36309407
4(1H)PYRIMIDINONE6(3CHLOROPHENYL)23DIHYDRO2THIOXO
6(3CHLOROPHENYL)23DIHYDRO2THIOXO4(1H)PYRIMIDINONE
6(3CHLOROPHENYL)2SULFANYLIDENE13DIHYDROPYRIMIDIN4ONE
ZINC45918681
6(3chlorophenyl)2sulfanylidene1Hpyrimidin4one
C1=CC(=CC(=C1)Cl)C2=CC(=O)NC(=S)N2
InChI=1SC10H7ClN2OSc1173126(47)859(14)1310(15)128h15H(H212131415)
BBL003079
Synonyms: 6-(3-methoxyphenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: COc1cccc(c1)c1cc(=O)[nH]c(=S)[nH]1
COc1cccc(c1)c1cc(=O)(nH)c(=S)(nH)1
6(3METHOXYPHENYL)2THIOXO23DIHYDRO1HPYRIMIDIN4ONE
6(3METHOXYPHENYL)2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
23DIHYDRO6(3METHOXYPHENYL)2THIOXO4(1H)PYRIMIDINONE
33166846
4(1H)PYRIMIDINONE23DIHYDRO6(3METHOXYPHENYL)2THIOXO
41HPYRIMIDINONE23DIHYDRO6(3METHOXYPHENYL)2THIOXO
6(3METHOXYPHENYL)2SULFANYLIDENE13DIHYDROPYRIMIDIN4ONE
ZINC19942596
6(3methoxyphenyl)2sulfanylidene1Hpyrimidin4one
COC1=CC=CC(=C1)C2=CC(=O)NC(=S)N2
InChI=1SC11H10N2O2Sc11584237(58)9610(14)1311(16)129h26H1H3(H212131416)
BBL003080
Synonyms: 7-ethyl-5-(4-fluorophenyl)[1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Smiles: CCc1cc2n[nH]c(=O)n2c(n1)c1ccc(cc1)F
CCc1cc2n(nH)c(=O)n2c(n1)c1ccc(cc1)F
ZINC45955705
1239770285
7ETHYL5(4FLUOROPHENYL)(124)TRIAZOLO(43C)PYRIMIDIN3(2H)ONE
7ethyl5(4fluorophenyl)2H(124)triazolo(43c)pyrimidin3one
CCC1=CC2=NNC(=O)N2C(=N1)C3=CC=C(C=C3)F
InChI=1SC13H11FN4Oc1210711161713(19)18(11)12(1510)8359(14)648h37H2H21H3(H1719)
BBL003081
Synonyms: 5,7,8-trimethyl[1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Smiles: Cc1nc(C)n2c(c1C)n[nH]c2=O
Cc1nc(C)n2c(c1C)n(nH)c2=O
ZINC45955783
1239729862
578TRIMETHYL(124)TRIAZOLO(43C)PYRIMIDIN3(2H)ONE
578trimethyl2H(124)triazolo(43c)pyrimidin3one
CC1=C(N=C(N2C1=NNC2=O)C)C
InChI=1SC8H10N4Oc145(2)96(3)127(4)10118(12)13h13H3(H1113)
BBL003082
Synonyms: 7,8-dimethyl-5-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Smiles: Cc1nc(c2ccncc2)n2c(c1C)n[nH]c2=O
Cc1nc(c2ccncc2)n2c(c1C)n(nH)c2=O
ZINC45955643
1239769562
78DIMETHYL5(PYRIDIN4YL)(124)TRIAZOLO(43C)PYRIMIDIN3(2H)ONE
78DIMETHYL5PYRIDIN4YL(124)TRIAZOLO(43C)PYRIMIDIN3(2H)ONE
78dimethyl5pyridin4yl2H(124)triazolo(43c)pyrimidin3one
CC1=C(N=C(N2C1=NNC2=O)C3=CC=NC=C3)C
InChI=1SC12H11N5Oc178(2)1411(93513649)1710(7)151612(17)18h36H12H3(H1618)
BBL003083
Synonyms: N-(2-fluorobenzyl)-4-(2-thioxo-2,3-dihydro-1H-imidazol-1-yl)benzamide
Smiles: O=C(c1ccc(cc1)n1cc[nH]c1=S)NCc1ccccc1F
O=C(c1ccc(cc1)n1cc(nH)c1=S)NCc1ccccc1F
ZINC32628429
1146289975
N((2FLUOROPHENYL)METHYL)4(2SULFANYLIDENE23DIHYDRO1HIMIDAZOL1YL)BENZAMIDE
N(2FLUOROBENZYL)4(2THIOXO23DIHYDRO1HIMIDAZOL1YL)BENZAMIDE
N(2FLUOROBENZYL)4(2THIOXO23DIHYDROIMIDAZOL1YL)BENZAMIDE
N((2fluorophenyl)methyl)4(2sulfanylidene1Himidazol3yl)benzamide
C1=CC=C(C(=C1)CNC(=O)C2=CC=C(C=C2)N3C=CNC3=S)F
InChI=1SC17H14FN3OSc1815421313(15)112016(22)125714(8612)211091917(21)23h110H11H2(H1923)(H2022)
BBL003084
Synonyms: 6-propyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: CCCc1cc(=O)[nH]c(=S)[nH]1
CCCc1cc(=O)(nH)c(=S)(nH)1
PMSPROPYLTHIOURACIL
PROPILTHIOURACIL
PROPILTIOURACILE
PROPILTIOURACILE(DCIT)
PROPILTIOURACILO
PROPYLTHIORIST
PROPYLTHIORIT
PROPYLTHIOURACIL
PROPYLTHIOURACIL(INNBANJAN)
PROPYLTHIOURACIL(JP15USPINN)
PROPYLTHIOURACIL(JP16USPINN)
PROPYLTHIOURACIL(TN)
PROPYLTHIOURACIL(USPINNBANJAN)
PROPYLTHIOURACIL6PROPYL2THIOURACIL
PROPYLTHIOURACILE
PROPYLTHIOURACILE(INNFRENCH)
PROPYLTHIOURACILSUPPLIEDBYSELLECKCHEMICALS
PROPYLTHIOURACILUM
PROPYLTHIOURACILUM(INNLATIN)
PROPYLTHYRACIL
PROPYTHIOURACIL
PROTHYRAN
PTU(THYREOSTATIC)
THIURAGYL
THYREOSTATII
THYREOSTATPROPYLTHYRACIL
TIROSTAT
URACIL6PROPYL2THIO
ZINC04640636
ZINC18213075
ZINC4640636
23DIHYDRO6PROPYL2THIOXO4(1H)PYRIMIDI
23DIHYDRO6PROPYL2THIOXO4(1H)PYRIMIDINONE
2MERCAPTO4HYDROXY6NPROPYLPYRIMIDINE
2MERCAPTO6PROPYL4PYRIMIDONE
2MERCAPTO6PROPYLPYRIMID4ONE
2MERCAPTO6PROPYLPYRIMIDIN4(3H)ONE
2MERCAPTO6PROPYLPYRIMIDIN4OL
2THIO4HYDROXY6NPROPYLPYRIMIDINE
2THIO4OXO6PROPYL13PYRIMIDINE
2THIO6PROPYL13PYRIMIDIN4ONE
4(1H)PYRIMIDINONE23DIHYDRO6PROPYL2THIOXO
4(1H)PYRIMIDINONE3DIHYDRO6PROPYL2THIOXO
4(1H)PYRIMIDINONE6BUTYL23DIHYDRO2THIOXO
4HYDROXY2MERCAPTO6PROPYLPYRIMIDINE
4HYDROXY6NPROPYLPYRIMIDINE2THIOL
4PROPYL2THIOURACIL
51525
6(NPROPYL)2THIOURACIL
6NPROPYL2MERCAPTO4HYDROXYPYRIMIDINE
6NPROPYL2THIOURACIL
6NPROPYLTHIOURACIL
6NPROPYLTHIOURACILPROPYLTHIOURACIL
6PROPILTIOURACILE
6PROPYL2SULFANYL3HPYRIMIDIN4ONE
6PROPYL2SULFANYL4PYRIMIDINOL
6PROPYL2SULFANYLIDENE1HPYRIMIDIN4ONE
6PROPYL2SULFANYLIDENE23DIHYDROPYRIMIDIN4(1H)ONE
6PROPYL2SULFANYLPYRIMIDIN4OL
6PROPYL2THIO23H)PYRIMIDINEDIONE
6PROPYL2THIO24(1H3H)PYRIMIDINEDIONE
6PROPYL2THIOPYRIMIDINE24(1H3H)DIONE
6PROPYL2THIOURACIL
6PROPYL2THIOXO1HPYRIMIDIN4ONE
6PROPYL2THIOXO23DIHYDRO1HPYRIMIDIN4ONE
6PROPYL2THIOXO23DIHYDRO4(1H)PYRIMIDINONE
6PROPYL2THIOXO23DIHYDROPYRIMIDIN4(1H)ONE
6PROPYL2THIOXO23DIHYDROPYRIMIDIN4ONE
6PROPYLTHIOURACIL
6THIO4PROPYLURACIL
APOPROPYLTHIOURACIL
CCCC1=CC(=O)NC(=S)N1
InChI=1SC7H10N2OSc123546(10)97(11)85h4H23H21H3(H2891011)
BBL003085
Synonyms: 6-fluoro-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: Fc1ccc2c(c1)c(=O)c(cn2C)C(=O)O
Fc1ccc2c(c1)c(=O)c(cn2C)C(=O)O
MFCD11557441
ZINC000022236110
ZINC22236110
2264337
6FLUORO1METHYL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
6FLUORO1METHYL4OXOHYDROQUINOLINE3CARBOXYLICACID
6fluoro1methyl4oxoquinoline3carboxylicacid
CN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)O
InChI=1SC11H8FNO3c11358(11(15)16)10(14)746(12)239(7)13h25H1H3(H1516)
BBL003086
Synonyms: ethyl6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1c[nH]c2c(c1=O)cc(cc2)F
CCOC(=O)c1c(nH)c2c(c1=O)cc(cc2)F
ETHYL6FLUORO14DIHYDRO4OXOQUINOLINE3CARBOXYLATE
ETHYL6FLUORO4HYDROXY3QUINOLINECARBOXYLATE
ETHYL6FLUORO4HYDROXYQUINOLIN3CARBOXYLATE
ETHYL6FLUORO4HYDROXYQUINOLINE3CARBOXYLATE
ETHYL6FLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLATE
ETHYL6FLUORO4OXO1HQUINOLINE3CARBOXYLATE
ETHYL6FLUORO4OXOHYDROQUINOLINE3CARBOXYLATE
ETHYLFLUOROHYDROXYQUINOLINECARBOXYLATE
14DIHYDRO4OXO6FLUOROQUINOLINE3CARBOXYLICACIDETHYLESTER
3(ETHOXYCARBONYL)6FLUORO4HYDROXY1AZANAPHTHALENE
3(ETHOXYCARBONYL)6FLUORO4HYDROXYQUINOLINE
3QUINOLINECARBOXYLICACID6FLUORO4HYDROXYETHYLESTER
4HYDROXY6FLUOROQUINOLINE3CARBOXYLICACIDETHYLESTER
6FLUORO14DIHYDRO4OXO3QUINOLINECARBOXYLICACIDETHYLESTER
6FLUORO4HYDROXY3QUINOLINECARBOXYLICACIDETHYLESTER
6FLUORO4HYDROXYQUINOLINE3CARBOXYLICACIDETHYLESTER
6FLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLICACIDETHYLESTER
71083006
MFCD03990483
ZINC000008700757
ZINC08700757
ZINC8700757
CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)F
InChI=1SC12H10FNO3c121712(16)961410437(13)58(10)11(9)15h36H2H21H3(H1415)
BBL003087
Synonyms: 1,6-dimethyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: Cc1ccc2c(c1)c(=O)c(cn2C)C(=O)O
Cc1ccc2c(c1)c(=O)c(cn2C)C(=O)O
MFCD01918236
ZINC000000117364
ZINC117364
16DIMETHYL4OXO14DIHYDROQUINOLINE3
16DIMETHYL4OXO14DIHYDROQUINOLINE3CARBOXY
16DIMETHYL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
16DIMETHYL4OXOHYDROQUINOLINE3CARBOXYLICACID
16DIMETHYL4OXOQUINOLINE3CARBOXYLICACID
51726433
CC1=CC2=C(C=C1)N(C=C(C2=O)C(=O)O)C
InChI=1SC12H11NO3c1734108(57)11(14)9(12(15)16)613(10)2h36H12H3(H1516)
BBL003088
Synonyms: 2-(4-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: Clc1ccc(cc1)n1cc(C(=O)O)c2c(c1=O)cccc2
Clc1ccc(cc1)n1cc(C(=O)O)c2c(c1=O)cccc2
ZINC109821
2(4CHLOROPHENYL)1OXO12DIHYDRO4ISOQUINOLINECARBOXYLICACID
2(4CHLOROPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID
2(4CHLOROPHENYL)1OXOISOQUINOLINE4CARBOXYLICACID
78364199
C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)O
InChI=1SC16H10ClNO3c17105711(8610)18914(16(20)21)12312413(12)15(18)19h19H(H2021)
BBL003089
Synonyms: 2-chloro-5-(pyrrolidin-1-ylsulfonyl)pyridine
Smiles: Clc1ccc(cn1)S(=O)(=O)N1CCCC1
Clc1ccc(cn1)S(=O)(=O)N1CCCC1
PYRIDINE2CHLORO5(1PYRROLIDINYLSULFONYL)
ZINC03317473
ZINC3317473
2CHLORO5(1PYRROLIDINYLSULFONYL)PYRIDINE
2CHLORO5(PYRROLIDIN1YLSULFONYL)PYRIDINE
2CHLORO5(PYRROLIDINE1SULFONYL)PYRIDINE
2CHLORO5(PYRROLIDINYLSULFONYL)PYRIDINE
2CHLORO5PYRROLIDIN1YLSULFONYLPYRIDINE
64614513
C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)Cl
InChI=1SC9H11ClN2O2Sc109438(7119)15(1314)12512612h347H1256H2
BBL003090
Synonyms: ethyl6-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1c[nH]c2c(c1=O)cc(cc2)C
CCOC(=O)c1c(nH)c2c(c1=O)cc(cc2)C
ETHYL4HYDROXY6METHYL3QUINOLINECARBOXYLATE
ETHYL4HYDROXY6METHYLQUINOLINE3CARBOXYLATE
ETHYL6METHYL4OXO14DIHYDROQUINOLINE3CARBOXYLATE
ETHYL6METHYL4OXO1HQUINOLINE3CARBOXYLATE
ETHYL6METHYL4OXOHYDROQUINOLINE3CARBOXYLATE
3QUINOLINECARBOXYLICACID14DIHYDRO6METHYL4OXOETHYLESTER
3QUINOLINECARBOXYLICACID4HYDROXY6METHYLETHYLESTER
4HYDROXY6METHYLQUINOLINE3CARBOXYLICACIDETHYLESTER
ZINC08887945
ZINC8887945
CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)C
InChI=1SC13H13NO3c131713(16)1071411548(2)69(11)12(10)15h47H3H212H3(H1415)
BBL003091
Synonyms: 1-ethyl-6-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1ccc(c2)C
CCn1cc(C(=O)O)c(=O)c2c1ccc(c2)C
ZINC22234591
1ETHYL6METHYL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
BBL003092
Synonyms: 6-fluoro-4-oxo-1-propyl-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCCn1cc(C(=O)O)c(=O)c2c1ccc(c2)F
CCCn1cc(C(=O)O)c(=O)c2c1ccc(c2)F
ZINC26508014
6FLUORO4OXO1PROPYL14DIHYDROQUINOLINE3CARBOXYLICACID
70032176
6fluoro4oxo1propylquinoline3carboxylicacid
CCCN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)O
InChI=1SC13H12FNO3c12515710(13(17)18)12(16)968(14)3411(9)15h3467H25H21H3(H1718)
BBL003093
Synonyms: 4-oxo-1-propyl-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCCn1cc(C(=O)O)c(=O)c2c1cccc2
CCCn1cc(C(=O)O)c(=O)c2c1cccc2
ZINC26507982
129686993
1PROPYL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
4OXO1PROPYL14DIHYDROQUINOLINE3CARBOXYLICACID
4oxo1propylquinoline3carboxylicacid
CCCN1C=C(C(=O)C2=CC=CC=C21)C(=O)O
InChI=1SC13H13NO3c12714810(13(16)17)12(15)9534611(9)14h368H27H21H3(H1617)
BBL003094
Synonyms: ethyl5-(chlorosulfonyl)-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1cn[nH]c1S(=O)(=O)Cl
CCOC(=O)c1cn(nH)c1S(=O)(=O)Cl
ETHYL3(CHLOROSULFONYL)1HPYRAZOLE4CARBOXYLATE
ETHYL5(CHLOROSULFONYL)1HPYRAZOLE4CARBOXYLATE
115703225
3CHLOROSULFONYL2HPYRAZOLE4CARBOXYLICACIDETHYLESTER
ZINC100027070
ethyl5chlorosulfonyl1Hpyrazole4carboxylate
CCOC(=O)C1=C(NN=C1)S(=O)(=O)Cl
InChI=1SC6H7ClN2O4Sc12136(10)43895(4)14(711)12h3H2H21H3(H89)
BBL003095
Synonyms: 4-oxo-3-phenyl-3,4-dihydrophthalazine-1-carboxylicacid
Smiles: OC(=O)c1nn(c2ccccc2)c(=O)c2c1cccc2
OC(=O)c1nn(c2ccccc2)c(=O)c2c1cccc2
ZINC000000215217
ZINC215217
MFCD00138610
1PHTHALAZINECARBOXYLICACID34DIHYDRO4OXO3PHENYL
4OXO3PHENYL34DIHYDRO1PHTHALAZINECARBOXYLICACID
4OXO3PHENYL34DIHYDROPHTHALAZINE1CARBOXYLICACID
4OXO3PHENYL3HYDROPHTHALAZINECARBOXYLICACID
4OXO3PHENYLPHTHALAZINE1CARBOXYLICACID
57531198
C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O
InChI=1SC15H10N2O3c181412954811(12)13(15(19)20)1617(14)106213710h19H(H1920)
BBL003096
Synonyms: 6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: Fc1ccc2c(c1)c(=O)c(c[nH]2)C(=O)O
Fc1ccc2c(c1)c(=O)c(c(nH)2)C(=O)O
FLUOROOXODIHYDROQUINOLINECARBOXYLICACID
MFCD03425825
ZINC000008926573
ZINC8926573
343102
3CARBOXY14DIHYDRO6FLUORO4OXOQUINOLINE
3CARBOXY6FLUORO4HYDROXYQUINOLINE
3QUINOLINECARBOXYLICACID6FLUORO14DIHYDRO4OXO
3QUINOLINECARBOXYLICACID6FLUORO4HYDROXY
6FLUORO14DIHYDRO4OXOQUINOLINE3CARBOXYLICACID
6FLUORO4HYDROXY3QUINOLINECARBOXYLICACID
6FLUORO4HYDROXYQUINOLINE3CARBOXYLICACID
6FLUORO4OXO14DIHYDRO3QUINOLINECARBOXYLICACID
6FLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
6FLUORO4OXO1HQUINOLINE3CARBOXYLICACID
6FLUORO4OXOHYDROQUINOLINE3CARBOXYLICACID
C1=CC2=C(C=C1F)C(=O)C(=CN2)C(=O)O
InChI=1SC10H6FNO3c1151286(35)9(13)7(4128)10(14)15h14H(H1213)(H1415)
BBL003097
Synonyms: 1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cccc2
CCn1cc(C(=O)O)c(=O)c2c1cccc2
MFCD00667561
ZINC000001459498
ZINC1459498
14DIHYDRO1ETHYL4OXOQUINOLINE3CARBOXYLICACID
1ETHYL14DIHYDRO4OXO3QUINOLINECARBOXYLICACID
1ETHYL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
1ETHYL4OXOHYDROQUINOLINE3CARBOXYLICACID
1ETHYL4OXOQUINOLINE3CARBOXYLICACID
23789880
3QUINOLINECARBOXYLICACID1ETHYL14DIHYDRO4OXO
CCN1C=C(C(=O)C2=CC=CC=C21)C(=O)O
InChI=1SC12H11NO3c121379(12(15)16)11(14)8534610(8)13h37H2H21H3(H1516)
BBL003098
Synonyms: 1-(4-chlorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
MFCD01871546
ZINC000000169526
ZINC169526
1(4CHLOROPHENYL)4OXO14DIHYDRO3PYRIDAZINECARBOXYLICACID
1(4CHLOROPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID
1(4CHLOROPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID
1(4CHLOROPHENYL)4OXOPYRIDAZINE3CARBOXYLICACID
147920341
3PYRIDAZINECARBOXYLICACID1(4CHLOROPHENYL)14DIHYDRO4OXO
CHLOROPHENYLOXODIHYDROPYRIDAZINECARBOXYLICACID
C1=CC(=CC=C1N2C=CC(=O)C(=N2)C(=O)O)Cl
InChI=1SC11H7ClN2O3c127138(427)14659(15)10(1314)11(16)17h16H(H1617)
BBL003099
Synonyms: 1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Fc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
Fc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
MFCD07427736
ZINC000006645496
ZINC6645496
1(4FLUOROPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID
1(4FLUOROPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID
1(4FLUOROPHENYL)4OXOPYRIDAZINE3CARBOXYLICACID
874401033
C1=CC(=CC=C1N2C=CC(=O)C(=N2)C(=O)O)F
InChI=1SC11H7FN2O3c127138(427)14659(15)10(1314)11(16)17h16H(H1617)
BBL003100
Synonyms: 1-(4-methoxyphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: COc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
COc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
MFCD01871681
ZINC000019702246
ZINC19702246
1(4METHOXYPHENYL)4OXO14DIHYDRO3PYRIDAZINECARBOXYLICACID
1(4METHOXYPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID
1(4METHOXYPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID
1(4METHOXYPHENYL)4OXOPYRIDAZINE3CARBOXYLICACID
478077666
COC1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O
InChI=1SC12H10N2O4c1189428(359)147610(15)11(1314)12(16)17h27H1H3(H1617)
BBL003101
Synonyms: 1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1ccc(c2)F
CCn1cc(C(=O)O)c(=O)c2c1ccc(c2)F
DEPIPERAZINYLNORFLOXACIN
MFCD00784834
ZINC000026463024
ZINC26463024
1ETHYL6FLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO4OXOHYDROQUINOLINE3CARBOXYLICACID
3832971
3QUINOLINECARBOXYLICACID1ETHYL6FLUORO14DIHYDRO4OXO
1ethyl6fluoro4oxoquinoline3carboxylicacid
CCN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)O
InChI=1SC12H10FNO3c121469(12(16)17)11(15)857(13)3410(8)14h36H2H21H3(H1617)
BBL003102
Synonyms: 4-oxo-1-phenyl-1,4-dihydropyridazine-3-carboxylicacid
Smiles: OC(=O)c1nn(ccc1=O)c1ccccc1
OC(=O)c1nn(ccc1=O)c1ccccc1
ZINC000001394410
ZINC1394410
MFCD01871600
147920374
3PYRIDAZINECARBOXYLICACID14DIHYDRO4OXO1PHENYL
4OXO1PHENYL14DIHYDRO3PYRIDAZINECARBOXYLICACID
4OXO1PHENYL14DIHYDROPYRIDAZINE3CARBOXYLICACID
4OXO1PHENYLHYDROPYRIDAZINE3CARBOXYLICACID
4OXO1PHENYLPYRIDAZINE3CARBOXYLICACID
C1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O
InChI=1SC11H8N2O3c1496713(1210(9)11(15)16)8421358h17H(H1516)
BBL003103
Synonyms: 6-chloro[1,3]dioxolo[4,5-g]quinoline-7-carbaldehyde
Smiles: O=Cc1cc2cc3OCOc3cc2nc1Cl
O=Cc1cc2cc3OCOc3cc2nc1Cl
ZINC000000381012
ZINC00381012
ZINC381012
MFCD02049248
2CHLORO67METHYLENEDIOXY3QUINOLINECARBOXALDEHYDE
332382817
6CHLORO(13)DIOXOLO(45G)QUINOLINE7CARBALDEHYDE
6CHLORO(13)DIOXOLO(45G)QUINOLINE7CARBOXALDEHYDE
6CHLORO13DIOXOLO(45G)QUINOLINE7CARBALDEHYDE
6CHLORO2H(13)DIOXOLO(45G)QUINOLINE7CARBALDEHYDE
6CHLORO2H13DIOXOLENO(45G)QUINOLINE7CARBALDEHYDE
C1OC2=CC3=CC(=C(N=C3C=C2O1)Cl)C=O
InChI=1SC11H6ClNO3c12117(414)162910(165159)38(6)1311h14H5H2
BBL003104
Synonyms: 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: Fc1ccc(cc1)n1cc(C(=O)O)c2c(c1=O)cccc2
Fc1ccc(cc1)n1cc(C(=O)O)c2c(c1=O)cccc2
ZINC2558756
2(4FLUOROPHENYL)1OXO12DIHYDRO4ISOQUINOLINECARBOXYLICACID
2(4FLUOROPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID
2(4FLUOROPHENYL)1OXOISOQUINOLINE4CARBOXYLICACID
339106831
C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)F)C(=O)O
InChI=1SC16H10FNO3c17105711(8610)18914(16(20)21)12312413(12)15(18)19h19H(H2021)
BBL003105
Synonyms: 2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: COc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2
COc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2
ZINC109860
2(3METHOXYPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID
2(3METHOXYPHENYL)1OXOISOQUINOLINE4CARBOXYLICACID
439141056
COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)O
InChI=1SC17H13NO4c1221264511(912)181015(17(20)21)13723814(13)16(18)19h210H1H3(H2021)
BBL003106
Synonyms: 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: Fc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2
Fc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2
ZINC49452786
1281914859
2(3FLUOROPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID
2(3fluorophenyl)1oxoisoquinoline4carboxylicacid
C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC(=CC=C3)F)C(=O)O
InChI=1SC16H10FNO3c171043511(810)18914(16(20)21)12612713(12)15(18)19h19H(H2021)
BBL003107
Synonyms: sodium(Z)-2-cyano-2-phenylethenolate
Smiles: [Na]O/C=C(/c1ccccc1)\C#N
(Na)OC=C(c1ccccc1)C#N
2FORMYL2PHENYLACETONITRILESODIUMENOLATE
SODIUM(Z)2CYANO2PHENYLETHENOLATE
C1=CC=C(C=C1)C(=C(O))C#N(Na+)
InChI=1SC9H7NONac1069(711)8421358h15711Hq+1p1b97+
BBL003108
Synonyms: sodium(Z)-2-cyano-2-(4-methylphenyl)ethenolate
Smiles: [Na]O/C=C(/c1ccc(cc1)C)\C#N
(Na)OC=C(c1ccc(cc1)C)C#N
1362859015
SODIUM(Z)2CYANO2(4METHYLPHENYL)ETHENOLATE
CC1=CC=C(C=C1)C(=C(O))C#N(Na+)
InChI=1SC10H9NONac18249(538)10(611)712h25712H1H3q+1p1b107+
BBL003109
Synonyms: sodium(Z)-2-cyano-2-(3-methoxyphenyl)ethenolate
Smiles: [Na]O/C=C(/c1cccc(c1)OC)\C#N
(Na)OC=C(c1cccc(c1)OC)C#N
SODIUM(Z)2CYANO2(3METHOXYPHENYL)ETHENOLATE
COC1=CC=CC(=C1)C(=C(O))C#N(Na+)
InChI=1SC10H9NO2Nac113104238(510)9(611)712h25712H1H3q+1p1b97+
BBL003110
Synonyms: sodium(Z)-2-cyano-2-(2-fluorophenyl)ethenolate
Smiles: [Na]O/C=C(/c1ccccc1F)\C#N
(Na)OC=C(c1ccccc1F)C#N
SODIUM(Z)2CYANO2(2FLUOROPHENYL)ETHENOLATE
C1=CC=C(C(=C1)C(=C(O))C#N)F(Na+)
InChI=1SC9H6FNONac10942138(9)7(511)612h14612Hq+1p1b76+
BBL003111
Synonyms: sodium(Z)-2-(4-chlorophenyl)-2-cyanoethenolate
Smiles: [Na]O/C=C(/c1ccc(cc1)Cl)\C#N
(Na)OC=C(c1ccc(cc1)Cl)C#N
SODIUM(Z)2(4CHLOROPHENYL)2CYANOETHENOLATE
C1=CC(=CC=C1C(=C(O))C#N)Cl(Na+)
InChI=1SC9H6ClNONac109317(249)8(511)612h14612Hq+1p1b86+
BBL003112
Synonyms: methyl3-{[(3,4-dimethylphenyl)sulfonyl]amino}thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1NS(=O)(=O)c1ccc(c(c1)C)C
COC(=O)c1sccc1NS(=O)(=O)c1ccc(c(c1)C)C
879844174
METHYL3(((34DIMETHYLPHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL3((34DIMETHYLPHENYL)SULFONYLAMINO)THIOPHENE2CARBOXYLATE
ZINC07230191
ZINC7230191
CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(SC=C2)C(=O)OC)C
InChI=1SC14H15NO4S2c194511(810(9)2)21(1718)1512672013(12)14(16)193h4815H13H3
BBL003113
Synonyms: 5-(pyrrolidin-1-ylsulfonyl)pyridin-2(1H)-one
Smiles: O=c1ccc(c[nH]1)S(=O)(=O)N1CCCC1
O=c1ccc(c(nH)1)S(=O)(=O)N1CCCC1
ZINC12504729
5(PYRROLIDIN1YLSULFONYL)PYRIDIN2(1H)ONE
5(PYRROLIDIN1YLSULFONYL)PYRIDIN2OL
5(PYRROLIDINE1SULFONYL)12DIHYDROPYRIDIN2ONE
5PYRROLIDIN1YLSULFONYL1HPYRIDIN2ONE
627843189
C1CCN(C1)S(=O)(=O)C2=CNC(=O)C=C2
InChI=1SC9H12N2O3Sc129438(7109)15(1314)11512611h347H1256H2(H1012)
BBL003114
Synonyms: 1-(4-ethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: CCc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
CCc1ccc(cc1)n1ccc(=O)c(n1)C(=O)O
ZINC19897837
1(4ETHYLPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID
1(4ETHYLPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID
1(4ETHYLPHENYL)4OXOPYRIDAZINE3CARBOXYLICACID
874354479
CCC1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O
InChI=1SC13H12N2O3c1293510(649)158711(16)12(1415)13(17)18h38H2H21H3(H1718)
BBL003115
Synonyms: 1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)O
Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)O
ZINC6759555
1(3METHYLPHENYL)4OXO14DIHYDROPYRIDAZINE3CARBOXYLICACID
1(3METHYLPHENYL)4OXOHYDROPYRIDAZINE3CARBOXYLICACID
1(3METHYLPHENYL)4OXOPYRIDAZINE3CARBOXYLICACID
874398615
CC1=CC(=CC=C1)N2C=CC(=O)C(=N2)C(=O)O
InChI=1SC12H10N2O3c183249(78)146510(15)11(1314)12(16)17h27H1H3(H1617)
BBL003116
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl)[4-(3-fluorophenyl)-3-(1H-pyrrol-1-yl)thiophen-2-yl]methanone
Smiles: Fc1cccc(c1)c1csc(c1n1cccc1)C(=O)n1nc(cc1C)C
Fc1cccc(c1)c1csc(c1n1cccc1)C(=O)n1nc(cc1C)C
ZINC67172385
(35DIMETHYL1HPYRAZOL1YL)(4(3FLUOROPHENYL)3(1HPYRROL1YL)THIOPHEN2YL)METHANONE
1325306942
(35dimethylpyrazol1yl)(4(3fluorophenyl)3pyrrol1ylthiophen2yl)methanone
CC1=CC(=NN1C(=O)C2=C(C(=CS2)C3=CC(=CC=C3)F)N4C=CC=C4)C
InChI=1SC20H16FN3OSc1131014(2)24(2213)20(25)1918(23834923)17(122619)1565716(21)1115h312H12H3
BBL003117
Synonyms: [4-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)thiophen-2-yl](3,5-dimethyl-1H-pyrazol-1-yl)methanone
Smiles: Clc1ccc(cc1)c1csc(c1n1cccc1)C(=O)n1nc(cc1C)C
Clc1ccc(cc1)c1csc(c1n1cccc1)C(=O)n1nc(cc1C)C
ZINC23126945
(4(4CHLOROPHENYL)3(1HPYRROL1YL)THIOPHEN2YL)(35DIMETHYL1HPYRAZOL1YL)METHANONE
1171861247
(4(4chlorophenyl)3pyrrol1ylthiophen2yl)(35dimethylpyrazol1yl)methanone
CC1=CC(=NN1C(=O)C2=C(C(=CS2)C3=CC=C(C=C3)Cl)N4C=CC=C4)C
InChI=1SC20H16ClN3OSc1131114(2)24(2213)20(25)1918(239341023)17(122619)155716(21)8615h312H12H3
BBL003118
Synonyms: 2-(3,4-dimethoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: COc1cc(ccc1OC)n1cc(C(=O)O)c2c(c1=O)cccc2
COc1cc(ccc1OC)n1cc(C(=O)O)c2c(c1=O)cccc2
ZINC67172386
1325303318
2(34DIMETHOXYPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID
2(34dimethoxyphenyl)1oxoisoquinoline4carboxylicacid
COC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)O)OC
InChI=1SC18H15NO5c123158711(916(15)242)191014(18(21)22)12534613(12)17(19)20h310H12H3(H2122)
BBL003119
Synonyms: 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylicacid
Smiles: Clc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2
Clc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2
MFCD03030472
ZINC35462383
1185101852
2(3CHLOROPHENYL)1OXO12DIHYDROISOQUINOLINE4CARBOXYLICACID
2(3chlorophenyl)1oxoisoquinoline4carboxylicacid
C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC(=CC=C3)Cl)C(=O)O
InChI=1SC16H10ClNO3c171043511(810)18914(16(20)21)12612713(12)15(18)19h19H(H2021)
BBL003120
Synonyms: 3-[(4-methylpiperidin-1-yl)sulfonyl]pyridin-2(1H)-one
Smiles: CC1CCN(CC1)S(=O)(=O)c1ccc[nH]c1=O
CC1CCN(CC1)S(=O)(=O)c1ccc(nH)c1=O
ZINC67172387
1325306179
3((4METHYLPIPERIDIN1YL)SULFONYL)12DIHYDROPYRIDIN2ONE
3((4METHYLPIPERIDIN1YL)SULFONYL)PYRIDIN2(1H)ONE
3(4methylpiperidin1yl)sulfonyl1Hpyridin2one
CC1CCN(CC1)S(=O)(=O)C2=CC=CNC2=O
InChI=1SC11H16N2O3Sc194713(859)17(1516)103261211(10)14h2369H4578H21H3(H1214)
BBL003121
Synonyms: 3-(azepan-1-ylsulfonyl)pyridin-2(1H)-one
Smiles: O=c1[nH]cccc1S(=O)(=O)N1CCCCCC1
O=c1(nH)cccc1S(=O)(=O)N1CCCCCC1
ZINC67172388
1325304811
3(AZEPAN1YLSULFONYL)PYRIDIN2(1H)ONE
3(azepan1ylsulfonyl)1Hpyridin2one
C1CCCN(CC1)S(=O)(=O)C2=CC=CNC2=O
InChI=1SC11H16N2O3Sc141110(6571211)17(1516)1383124913h57H1489H2(H1214)
BBL003122
Synonyms: ethyl6,7-difluoro-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: Cn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F
Cn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F
ETHYL67DIFLUORO1METHYL4OXO14DIHYDROQUINOLINE3CARBOXYLATE
124458077
67DIFLUORO14DIHYDRO1METHYL4OXOQUINOLINE3CARBOXYLICACIDETHYLESTER
ZINC12415735
ethyl67difluoro1methyl4oxoquinoline3carboxylate
CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)F)C
InChI=1SC13H11F2NO3c131913(18)8616(2)11510(15)9(14)47(11)12(8)17h46H3H212H3
BBL003123
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl)[4-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)thiophen-2-yl]methanone
Smiles: Fc1ccc(cc1)c1csc(c1n1cccc1)C(=O)n1nc(cc1C)C
Fc1ccc(cc1)c1csc(c1n1cccc1)C(=O)n1nc(cc1C)C
ZINC16843461
(35DIMETHYL1HPYRAZOL1YL)(4(4FLUOROPHENYL)3(1HPYRROL1YL)THIOPHEN2YL)METHANONE
1203153018
(35dimethylpyrazol1yl)(4(4fluorophenyl)3pyrrol1ylthiophen2yl)methanone
CC1=CC(=NN1C(=O)C2=C(C(=CS2)C3=CC=C(C=C3)F)N4C=CC=C4)C
InChI=1SC20H16FN3OSc1131114(2)24(2213)20(25)1918(239341023)17(122619)155716(21)8615h312H12H3
BBL003124
Synonyms: 3-{[(4-methoxyphenyl)sulfonyl]amino}thiophene-2-carboxylicacid
Smiles: COc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O
COc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O
ZINC35306506
1153392916
3(((4METHOXYPHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLICACID
3(4METHOXYBENZENESULFONAMIDO)THIOPHENE2CARBOXYLICACID
3((4methoxyphenyl)sulfonylamino)thiophene2carboxylicacid
COC1=CC=C(C=C1)S(=O)(=O)NC2=C(SC=C2)C(=O)O
InChI=1SC12H11NO5S2c1188249(538)20(1617)1310671911(10)12(14)15h2713H1H3(H1415)
BBL003125
Synonyms: 3-{[(4-bromophenyl)sulfonyl]amino}thiophene-2-carboxylicacid
Smiles: Brc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O
Brc1ccc(cc1)S(=O)(=O)Nc1ccsc1C(=O)O
ZINC35010674
2THIOPHENECARBOXYLICACID3(((4BROMOPHENYL)SULFONYL)AMINO)
3(((4BROMOPHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLICACID
3((4BROMOPHENYL)SULFONYLAMINO)THIOPHENE2CARBOXYLICACID
959352557
C1=CC(=CC=C1S(=O)(=O)NC2=C(SC=C2)C(=O)O)Br
InChI=1SC11H8BrNO4S2c127138(427)19(1617)139561810(9)11(14)15h1613H(H1415)
BBL003126
Synonyms: 3-{[(4-tert-butylphenyl)sulfonyl](methyl)amino}thiophene-2-carboxylicacid
Smiles: OC(=O)c1sccc1N(S(=O)(=O)c1ccc(cc1)C(C)(C)C)C
OC(=O)c1sccc1N(S(=O)(=O)c1ccc(cc1)C(C)(C)C)C
ZINC67172389
1111300436
3(((4TERTBUTYLPHENYL)SULFONYL)(METHYL)AMINO)THIOPHENE2CARBOXYLICACID
3((4tertbutylphenyl)sulfonylmethylamino)thiophene2carboxylicacid
CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)O
InChI=1SC16H19NO4S2c116(23)115712(8611)23(2021)17(4)139102214(13)15(18)19h510H14H3(H1819)
BBL003127
Synonyms: methyl3-(methyl{[4-(propan-2-yl)phenyl]sulfonyl}amino)thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1N(S(=O)(=O)c1ccc(cc1)C(C)C)C
COC(=O)c1sccc1N(S(=O)(=O)c1ccc(cc1)C(C)C)C
1325304902
METHYL3(((4ISOPROPYLPHENYL)SULFONYL)(METHYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL3(METHYL((4(PROPAN2YL)PHENYL)SULFONYL)AMINO)THIOPHENE2CARBOXYLATE
ZINC67172390
methyl3(methyl(4propan2ylphenyl)sulfonylamino)thiophene2carboxylate
CC(C)C1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)OC
InChI=1SC16H19NO4S2c111(2)125713(8612)23(1920)17(3)149102215(14)16(18)214h511H14H3
BBL003128
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-ethylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccccc1)c1ccsc1C(=O)n1nc(cc1C)C
CCN(S(=O)(=O)c1ccccc1)c1ccsc1C(=O)n1nc(cc1C)C
1325306806
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)NETHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NETHYLBENZENESULFONAMIDE
ZINC67172391
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nethylbenzenesulfonamide
CCN(C1=C(SC=C1)C(=O)N2C(=CC(=N2)C)C)S(=O)(=O)C3=CC=CC=C3
InChI=1SC18H19N3O3S2c1420(26(2324)158657915)1610112517(16)18(22)2114(3)1213(2)1921h512H4H213H3
BBL003129
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-ethyl-4-methylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)C)c1ccsc1C(=O)n1nc(cc1C)C
CCN(S(=O)(=O)c1ccc(cc1)C)c1ccsc1C(=O)n1nc(cc1C)C
1325303329
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)NETHYL4METHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NETHYL4METHYLBENZENESULFONAMIDE
ZINC67172392
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nethyl4methylbenzenesulfonamide
CCN(C1=C(SC=C1)C(=O)N2C(=CC(=N2)C)C)S(=O)(=O)C3=CC=C(C=C3)C
InChI=1SC19H21N3O3S2c1521(27(2425)168613(2)7916)1710112618(17)19(23)2215(4)1214(3)2022h612H5H214H3
BBL003130
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-4-ethyl-N-methylbenzenesulfonamide
Smiles: CCc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
CCc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
1325303987
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)4ETHYLNMETHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)4ETHYLNMETHYLBENZENESULFONAMIDE
ZINC67172393
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)4ethylNmethylbenzenesulfonamide
CCC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C
InChI=1SC19H21N3O3S2c15156816(9715)27(2425)21(4)1710112618(17)19(23)2214(3)1213(2)2022h612H5H214H3
BBL003131
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-methyl-4-propylbenzenesulfonamide
Smiles: CCCc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
CCCc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
1325306953
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)NMETHYL4PROPYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NMETHYL4PROPYLBENZENESULFONAMIDE
ZINC67172394
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nmethyl4propylbenzenesulfonamide
CCCC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C
InChI=1SC20H23N3O3S2c156167917(10816)28(2526)22(4)1811122719(18)20(24)2315(3)1314(2)2123h713H56H214H3
BBL003132
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-methyl-4-(propan-2-yl)benzenesulfonamide
Smiles: Cc1nn(c(c1)C)C(=O)c1sccc1N(S(=O)(=O)c1ccc(cc1)C(C)C)C
Cc1nn(c(c1)C)C(=O)c1sccc1N(S(=O)(=O)c1ccc(cc1)C(C)C)C
1325303374
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)4ISOPROPYLNMETHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NMETHYL4(PROPAN2YL)BENZENESULFONAMIDE
ZINC67172395
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nmethyl4propan2ylbenzenesulfonamide
CC1=CC(=NN1C(=O)C2=C(C=CS2)N(C)S(=O)(=O)C3=CC=C(C=C3)C(C)C)C
InChI=1SC20H23N3O3S2c113(2)166817(9716)28(2526)22(5)1810112719(18)20(24)2315(4)1214(3)2123h613H15H3
BBL003133
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N,3,4-trimethylbenzenesulfonamide
Smiles: Cc1cc(n(n1)C(=O)c1sccc1N(S(=O)(=O)c1ccc(c(c1)C)C)C)C
Cc1cc(n(n1)C(=O)c1sccc1N(S(=O)(=O)c1ccc(c(c1)C)C)C)C
1325305256
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)N34TRIMETHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)N34TRIMETHYLBENZENESULFONAMIDE
ZINC67172396
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)N34trimethylbenzenesulfonamide
CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C)C
InChI=1SC19H21N3O3S2c1126716(1013(12)2)27(2425)21(5)17892618(17)19(23)2215(4)1114(3)2022h611H15H3
BBL003134
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N,2,4,6-tetramethylbenzenesulfonamide
Smiles: Cc1cc(C)c(c(c1)C)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
Cc1cc(C)c(c(c1)C)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
1325306191
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)N246TETRAMETHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)N246TETRAMETHYLBENZENESULFONAMIDE
ZINC67172397
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)N246tetramethylbenzenesulfonamide
CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C)C2=C(SC=C2)C(=O)N3C(=CC(=N3)C)C)C
InChI=1SC20H23N3O3S2c112913(2)19(14(3)1012)28(2526)22(6)17782718(17)20(24)2316(5)1115(4)2123h711H16H3
BBL003135
Synonyms: N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-4-methoxy-N-methylbenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
COc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
1325306602
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)4METHOXYNMETHYLBENZENESULFONAMIDE
N(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)4METHOXYNMETHYLBENZENESULFONAMIDE
ZINC67172398
N(2(35dimethylpyrazole1carbonyl)thiophen3yl)4methoxyNmethylbenzenesulfonamide
CC1=CC(=NN1C(=O)C2=C(C=CS2)N(C)S(=O)(=O)C3=CC=C(C=C3)OC)C
InChI=1SC18H19N3O4S2c1121113(2)21(1912)18(22)1716(9102617)20(3)27(2324)157514(254)6815h511H14H3
BBL003136
Synonyms: 3-chloro-N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-methylbenzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
Clc1cccc(c1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
ZINC67172399
1325304833
3CHLORON(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)NMETHYLBENZENESULFONAMIDE
3CHLORON(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NMETHYLBENZENESULFONAMIDE
3chloroN(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nmethylbenzenesulfonamide
CC1=CC(=NN1C(=O)C2=C(C=CS2)N(C)S(=O)(=O)C3=CC(=CC=C3)Cl)C
InChI=1SC17H16ClN3O3S2c111912(2)21(1911)17(22)1615(782516)20(3)26(2324)1464513(18)1014h410H13H3
BBL003137
Synonyms: 4-chloro-N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-methylbenzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
Clc1ccc(cc1)S(=O)(=O)N(c1ccsc1C(=O)n1nc(cc1C)C)C
ZINC67172400
1325303330
4CHLORON(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)NMETHYLBENZENESULFONAMIDE
4CHLORON(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NMETHYLBENZENESULFONAMIDE
4chloroN(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nmethylbenzenesulfonamide
CC1=CC(=NN1C(=O)C2=C(C=CS2)N(C)S(=O)(=O)C3=CC=C(C=C3)Cl)C
InChI=1SC17H16ClN3O3S2c1111012(2)21(1911)17(22)1615(892516)20(3)26(2324)146413(18)5714h410H13H3
BBL003138
Synonyms: 4-chloro-N-{2-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]thiophen-3-yl}-N-ethylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)Cl)c1ccsc1C(=O)n1nc(cc1C)C
CCN(S(=O)(=O)c1ccc(cc1)Cl)c1ccsc1C(=O)n1nc(cc1C)C
ZINC67172401
1325305881
4CHLORON(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)3THIENYL)NETHYLBENZENESULFONAMIDE
4CHLORON(2((35DIMETHYL1HPYRAZOL1YL)CARBONYL)THIOPHEN3YL)NETHYLBENZENESULFONAMIDE
4chloroN(2(35dimethylpyrazole1carbonyl)thiophen3yl)Nethylbenzenesulfonamide
CCN(C1=C(SC=C1)C(=O)N2C(=CC(=N2)C)C)S(=O)(=O)C3=CC=C(C=C3)Cl
InChI=1SC18H18ClN3O3S2c1421(27(2425)157514(19)6815)169102617(16)18(23)2213(3)1112(2)2022h511H4H213H3
BBL003139
Synonyms: 4-[(2-chloropyridin-3-yl)sulfonyl]thiomorpholine
Smiles: Clc1ncccc1S(=O)(=O)N1CCSCC1
Clc1ncccc1S(=O)(=O)N1CCSCC1
ZINC35358525
1156386149
4((2CHLOROPYRIDIN3YL)SULFONYL)THIOMORPHOLINE
4(2chloropyridin3yl)sulfonylthiomorpholine
C1CSCCN1S(=O)(=O)C2=C(N=CC=C2)Cl
InChI=1SC9H11ClN2O2S2c1098(213119)16(1314)1246157512h13H47H2
BBL003140
Synonyms: 1-[(6-chloropyridin-3-yl)sulfonyl]-4-(propan-2-yl)piperazine
Smiles: CC(N1CCN(CC1)S(=O)(=O)c1ccc(nc1)Cl)C
CC(N1CCN(CC1)S(=O)(=O)c1ccc(nc1)Cl)C
ZINC35216004
1((6CHLOROPYRIDIN3YL)SULFONYL)4(PROPAN2YL)PIPERAZINE
1((6CHLOROPYRIDIN3YL)SULFONYL)4ISOPROPYLPIPERAZINE
612487522
1(6chloropyridin3yl)sulfonyl4propan2ylpiperazine
CC(C)N1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)Cl
InChI=1SC12H18ClN3O2Sc110(2)155716(8615)19(1718)113412(13)14911h34910H58H212H3
BBL003141
Synonyms: N-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CC(c1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2)C
CC(c1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2)C
1325305790
N(4(PROPAN2YL)PHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
N(4ISOPROPYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
ZINC67172402
N(4propan2ylphenyl)(124)triazolo(43a)pyridine8sulfonamide
CC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CN3C2=NN=C3
InChI=1SC15H16N4O2Sc111(2)125713(8612)1822(2021)144391910161715(14)19h31118H12H3
BBL003142
Synonyms: 3-methyl-N-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CC(c1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C)C
CC(c1ccc(cc1)NS(=O)(=O)c1cccn2c1nnc2C)C
1325303170
3METHYLN(4(PROPAN2YL)PHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
ZINC67172403
3methylN(4propan2ylphenyl)(124)triazolo(43a)pyridine8sulfonamide
CC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)C(C)C
InChI=1SC16H18N4O2Sc111(2)136814(9713)1923(2122)1554102012(3)171816(15)20h41119H13H3
BBL003143
Synonyms: 3-ethyl-N-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(cc1)C(C)C
CCc1nnc2n1cccc2S(=O)(=O)Nc1ccc(cc1)C(C)C
ZINC67172404
1325306839
3ETHYLN(4(PROPAN2YL)PHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
3ethylN(4propan2ylphenyl)(124)triazolo(43a)pyridine8sulfonamide
CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)C(C)C
InChI=1SC17H20N4O2Sc141618191715(651121(16)17)24(2223)20149713(81014)12(2)3h51220H4H213H3
BBL003144
Synonyms: N-(3,5-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Fc1cc(cc(c1)F)NS(=O)(=O)c1cccn2c1nnc2
Fc1cc(cc(c1)F)NS(=O)(=O)c1cccn2c1nnc2
1325307365
N(35DIFLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
ZINC67172405
C1=CN2C=NN=C2C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)F)F
InChI=1SC12H8F2N4O2Sc13849(14)610(58)1721(1920)11213187151612(11)18h1717H
BBL003145
Synonyms: N-(3,5-difluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: Fc1cc(cc(c1)F)NS(=O)(=O)c1cccn2c1nnc2C
Fc1cc(cc(c1)F)NS(=O)(=O)c1cccn2c1nnc2C
1325306624
N(35DIFLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
ZINC67172406
CC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC(=C3)F)F
InChI=1SC13H10F2N4O2Sc1816171312(32419(8)13)22(2021)181169(14)510(15)711h2718H1H3
BBL003146
Synonyms: N-(3,5-difluorophenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
Smiles: CCc1nnc2n1cccc2S(=O)(=O)Nc1cc(F)cc(c1)F
CCc1nnc2n1cccc2S(=O)(=O)Nc1cc(F)cc(c1)F
1325305290
N(35DIFLUOROPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE8SULFONAMIDE
ZINC67172407
CCC1=NN=C2N1C=CC=C2S(=O)(=O)NC3=CC(=CC(=C3)F)F
InChI=1SC14H12F2N4O2Sc121317181412(43520(13)14)23(2122)191179(15)610(16)811h3819H2H21H3
BBL003147
Synonyms: N-phenyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: O=S(=O)(c1ccc2n(c1)cnn2)Nc1ccccc1
O=S(=O)(c1ccc2n(c1)cnn2)Nc1ccccc1
ZINC65198850
1325304855
NPHENYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
C1=CC=C(C=C1)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC12H10N4O2Sc1719(1815104213510)1167121413916(12)811h1915H
BBL003148
Synonyms: 3-methyl-N-phenyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Cc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccccc1
Cc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccccc1
1325305767
3METHYLNPHENYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172408
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3
InChI=1SC13H12N4O2Sc1101415138712(917(10)13)20(1819)16115324611h2916H1H3
BBL003149
Synonyms: 3-ethyl-N-phenyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccccc1
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccccc1
1325306975
3ETHYLNPHENYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172409
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3
InChI=1SC14H14N4O2Sc12131516149812(1018(13)14)21(1920)17116435711h31017H2H21H3
BBL003150
Synonyms: 3-methyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Cc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Cc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325305870
3METHYLN(3METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65198925
CC1=CC(=CC=C1)NS(=O)(=O)C2=CN3C(=NN=C3C=C2)C
InChI=1SC14H14N4O2Sc11043512(810)1721(1920)136714161511(2)18(14)913h3917H12H3
BBL003151
Synonyms: N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Cc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)cnn2
Cc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)cnn2
1325306851
N(3METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65198917
CC1=CC(=CC=C1)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC13H12N4O2Sc11032411(710)1620(1819)1256131514917(13)812h2916H1H3
BBL003152
Synonyms: N-(4-ethylphenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
CCc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1251594305
N(4ETHYLPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC49408268
CCC1=CC=C(C=C1)NS(=O)(=O)C2=CN3C(=NN=C3C=C2)C
InChI=1SC15H16N4O2Sc13124613(7512)1822(2021)148915171611(2)19(15)1014h41018H3H212H3
BBL003153
Synonyms: N-(4-ethylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
CCc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
1325306691
N(4ETHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65198968
CCC1=CC=C(C=C1)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC14H14N4O2Sc12113512(6411)1721(1920)13781416151018(14)913h31017H2H21H3
BBL003154
Synonyms: N-(3-fluoro-4-methylphenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cc(ccc1C)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Fc1cc(ccc1C)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325306657
N(3FLUORO4METHYLPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172410
CC1=C(C=C(C=C1)NS(=O)(=O)C2=CN3C(=NN=C3C=C2)C)F
InChI=1SC14H13FN4O2Sc193411(713(9)15)1822(2021)125614171610(2)19(14)812h3818H12H3
BBL003155
Synonyms: N-(3-fluoro-4-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cc(ccc1C)NS(=O)(=O)c1ccc2n(c1)cnn2
Fc1cc(ccc1C)NS(=O)(=O)c1ccc2n(c1)cnn2
1325307376
N(3FLUORO4METHYLPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172411
CC1=C(C=C(C=C1)NS(=O)(=O)C2=CN3C=NN=C3C=C2)F
InChI=1SC13H11FN4O2Sc192310(612(9)14)1721(1920)1145131615818(13)711h2817H1H3
BBL003156
Synonyms: N-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: COc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
COc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
1251620297
N(4METHOXYPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC49408289
COC1=CC=C(C=C1)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC13H12N4O3Sc120114210(3511)1621(1819)1267131514917(13)812h2916H1H3
BBL003157
Synonyms: N-(4-methoxyphenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: COc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
COc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1251594394
N(4METHOXYPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC49408320
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)OC
InChI=1SC14H14N4O3Sc1101516148713(918(10)14)22(1920)17113512(212)6411h3917H12H3
BBL003158
Synonyms: 3-ethyl-N-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: COc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(CC)nn2
COc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(CC)nn2
1325303352
3ETHYLN(4METHOXYPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172412
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)OC
InChI=1SC15H16N4O3Sc13141617159813(1019(14)15)23(2021)18114612(222)7511h41018H3H212H3
BBL003159
Synonyms: N-(4-ethoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCOc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
CCOc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
1325304899
N(4ETHOXYPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199007
CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC14H14N4O3Sc1221125311(4612)1722(1920)13781416151018(14)913h31017H2H21H3
BBL003160
Synonyms: N-(4-ethoxyphenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCOc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
CCOc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325306873
N(4ETHOXYPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172413
CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CN3C(=NN=C3C=C2)C
InChI=1SC15H16N4O3Sc1322136412(5713)1823(2021)148915171611(2)19(15)1014h41018H3H212H3
BBL003161
Synonyms: N-(1,3-benzodioxol-5-yl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: O=S(=O)(c1ccc2n(c1)cnn2)Nc1ccc2c(c1)OCO2
O=S(=O)(c1ccc2n(c1)cnn2)Nc1ccc2c(c1)OCO2
ZINC65199027
1325305314
N(13BENZODIOXOL5YL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CN4C=NN=C4C=C3
InChI=1SC13H10N4O4Sc1822(191024131514717(13)610)169131112(59)2182011h1716H8H2
BBL003162
Synonyms: N-(1,3-benzodioxol-5-yl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Cc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc2c(c1)OCO2
Cc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc2c(c1)OCO2
1325306964
N(13BENZODIOXOL5YL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199045
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC14H12N4O4Sc191516145311(718(9)14)23(1920)1710241213(610)2282112h2717H8H21H3
BBL003163
Synonyms: N-(1,3-benzodioxol-5-yl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc2c(c1)OCO2
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc2c(c1)OCO2
1325303874
N(13BENZODIOXOL5YL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199053
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC15H14N4O4Sc12141617156411(819(14)15)24(2021)1810351213(710)2392212h3818H29H21H3
BBL003164
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: O=S(=O)(c1ccc2n(c1)cnn2)Nc1ccc2c(c1)OCCO2
O=S(=O)(c1ccc2n(c1)cnn2)Nc1ccc2c(c1)OCCO2
ZINC49408412
1251594485
N(23DIHYDRO14BENZODIOXIN6YL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
N(23DIHYDROBENZO(B)(14)DIOXIN6YL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
C1COC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CN4C=NN=C4C=C3
InChI=1SC14H12N4O4Sc1923(201124141615918(14)811)1710131213(710)22652112h147917H56H2
BBL003165
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Cc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc2c(c1)OCCO2
Cc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc2c(c1)OCCO2
N(23DIHYDRO14BENZODIOXIN6YL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199071
BBL003166
Synonyms: N-(4-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
Fc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
1325303410
N(4FLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199132
C1=CC(=CC=C1NS(=O)(=O)C2=CN3C=NN=C3C=C2)F
InChI=1SC12H9FN4O2Sc1391310(429)1620(1819)1156121514817(12)711h1816H
BBL003167
Synonyms: N-(4-fluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Fc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325306704
N(4FLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199165
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)F
InChI=1SC13H11FN4O2Sc191516137612(818(9)13)21(1920)17114210(14)3511h2817H1H3
BBL003168
Synonyms: 3-ethyl-N-(4-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc(cc1)F
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc(cc1)F
1325306908
3ETHYLN(4FLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199191
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)F
InChI=1SC14H13FN4O2Sc12131617148712(919(13)14)22(2021)18115310(15)4611h3918H2H21H3
BBL003169
Synonyms: N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)cnn2
Fc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)cnn2
1325304924
N(3FLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199079
C1=CC(=CC(=C1)F)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC12H9FN4O2Sc13921310(69)1620(1819)1145121514817(12)711h1816H
BBL003170
Synonyms: N-(3-fluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Fc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325303385
N(3FLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC67172414
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)F
InChI=1SC13H11FN4O2Sc191516136512(818(9)13)21(1920)171142310(14)711h2817H1H3
BBL003171
Synonyms: 3-ethyl-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1cccc(c1)F
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1cccc(c1)F
1325305814
3ETHYLN(3FLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199124
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)F
InChI=1SC14H13FN4O2Sc12131617147612(919(13)14)22(2021)181153410(15)811h3918H2H21H3
BBL003172
Synonyms: N-(3,4-difluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cc(ccc1F)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Fc1cc(ccc1F)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325303443
N(34DIFLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199217
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)F)F
InChI=1SC13H10F2N4O2Sc181617135310(719(8)13)22(2021)1892411(14)12(15)69h2718H1H3
BBL003173
Synonyms: N-(3,4-difluorophenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc(c(c1)F)F
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc(c(c1)F)F
1325307398
N(34DIFLUOROPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199237
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)F)F
InChI=1SC14H12F2N4O2Sc12131718146410(820(13)14)23(2122)1993511(15)12(16)79h3819H2H21H3
BBL003174
Synonyms: N-(3,5-difluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cc(cc(c1)F)NS(=O)(=O)c1ccc2n(c1)cnn2
Fc1cc(cc(c1)F)NS(=O)(=O)c1ccc2n(c1)cnn2
1325306679
N(35DIFLUOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199246
C1=CC2=NN=CN2C=C1S(=O)(=O)NC3=CC(=CC(=C3)F)F
InChI=1SC12H8F2N4O2Sc13839(14)510(48)1721(1920)1112121615718(12)611h1717H
BBL003175
Synonyms: N-(3,5-difluorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Fc1cc(cc(c1)F)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Fc1cc(cc(c1)F)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1325303896
N(35DIFLUOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199269
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)F)F
InChI=1SC13H10F2N4O2Sc181617133212(719(8)13)22(2021)181159(14)410(15)611h2718H1H3
BBL003176
Synonyms: N-(3,5-difluorophenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1cc(F)cc(c1)F
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1cc(F)cc(c1)F
1325303205
N(35DIFLUOROPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199280
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)F)F
InChI=1SC14H12F2N4O2Sc12131718144312(820(13)14)23(2122)191169(15)510(16)711h3819H2H21H3
BBL003177
Synonyms: N-(3-chlorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Clc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)cnn2
Clc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)cnn2
1251633416
N(3CHLOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC49408608
C1=CC(=CC(=C1)Cl)NS(=O)(=O)C2=CN3C=NN=C3C=C2
InChI=1SC12H9ClN4O2Sc13921310(69)1620(1819)1145121514817(12)711h1816H
BBL003178
Synonyms: N-(3-chlorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Clc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Clc1cccc(c1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1251561111
N(3CHLOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC49408614
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)Cl
InChI=1SC13H11ClN4O2Sc191516136512(818(9)13)21(1920)171142310(14)711h2817H1H3
BBL003179
Synonyms: N-(4-chlorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Clc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
Clc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)cnn2
1325306986
N(4CHLOROPHENYL)(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199317
C1=CC(=CC=C1NS(=O)(=O)C2=CN3C=NN=C3C=C2)Cl
InChI=1SC12H9ClN4O2Sc1391310(429)1620(1819)1156121514817(12)711h1816H
BBL003180
Synonyms: N-(4-chlorophenyl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: Clc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
Clc1ccc(cc1)NS(=O)(=O)c1ccc2n(c1)c(C)nn2
1251594963
N(4CHLOROPHENYL)3METHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC49408634
CC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl
InChI=1SC13H11ClN4O2Sc191516137612(818(9)13)21(1920)17114210(14)3511h2817H1H3
BBL003181
Synonyms: N-(4-chlorophenyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Smiles: CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc(cc1)Cl
CCc1nnc2n1cc(cc2)S(=O)(=O)Nc1ccc(cc1)Cl
1325307412
N(4CHLOROPHENYL)3ETHYL(124)TRIAZOLO(43A)PYRIDINE6SULFONAMIDE
ZINC65199339
CCC1=NN=C2N1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl
InChI=1SC14H13ClN4O2Sc12131617148712(919(13)14)22(2021)18115310(15)4611h3918H2H21H3
BBL003182
Synonyms: 4-(3-fluoro-4-methylphenyl)-2H-pyrido[2,3-e][1,2,4]thiadiazin-3(4H)-one1,1-dioxide
Smiles: O=C1NS(=O)(=O)c2c(N1c1ccc(c(c1)F)C)nccc2
O=C1NS(=O)(=O)c2c(N1c1ccc(c(c1)F)C)nccc2
ZINC67172415
1325303396
4(3FLUORO4METHYLPHENYL)2HPYRIDO(23E)(124)THIADIAZIN3(4H)ONE11DIOXIDE
4(3fluoro4methylphenyl)11dioxopyrido(23e)(124)thiadiazin3one
CC1=C(C=C(C=C1)N2C3=C(C=CC=N3)S(=O)(=O)NC2=O)F
InChI=1SC13H10FN3O3Sc18459(710(8)14)171211(3261512)21(1920)1613(17)18h27H1H3(H1618)
BBL003183
Synonyms: 4-(4-fluoro-3-methylphenyl)-2H-pyrido[2,3-e][1,2,4]thiadiazin-3(4H)-one1,1-dioxide
Smiles: O=C1NS(=O)(=O)c2c(N1c1ccc(c(c1)C)F)nccc2
O=C1NS(=O)(=O)c2c(N1c1ccc(c(c1)C)F)nccc2
ZINC67172416
1325305836
4(4FLUORO3METHYLPHENYL)2HPYRIDO(23E)(124)THIADIAZIN3(4H)ONE11DIOXIDE
4(4fluoro3methylphenyl)11dioxopyrido(23e)(124)thiadiazin3one
CC1=C(C=CC(=C1)N2C3=C(C=CC=N3)S(=O)(=O)NC2=O)F
InChI=1SC13H10FN3O3Sc1879(4510(8)14)171211(3261512)21(1920)1613(17)18h27H1H3(H1618)
BBL003184
Synonyms: 5-(azepan-1-ylsulfonyl)pyridin-2(1H)-one
Smiles: O=c1ccc(c[nH]1)S(=O)(=O)N1CCCCCC1
O=c1ccc(c(nH)1)S(=O)(=O)N1CCCCCC1
ZINC36828739
1154883507
5(AZEPAN1YLSULFONYL)PYRIDIN2(1H)ONE
5(AZEPANE1SULFONYL)12DIHYDROPYRIDIN2ONE
5(azepan1ylsulfonyl)1Hpyridin2one
C1CCCN(CC1)S(=O)(=O)C2=CNC(=O)C=C2
InChI=1SC11H16N2O3Sc14116510(91211)17(1516)1373124813h569H1478H2(H1214)
BBL003185
Synonyms: 1-ethyl-6-fluoro-7-(morpholin-4-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCOCC1)c(c2)F
CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCOCC1)c(c2)F
ZINC184452
1ETHYL6FLUORO14DIHYDRO4OXO7MORPHOLINO3QUINOLINECARBOXYLICACID
1ETHYL6FLUORO7(MORPHOLIN4YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO7MORPHOLIN4YL4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO7MORPHOLIN4YL4OXOQUINOLINE3CARBOXYLICACID
70458989
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCOCC3)F)C(=O)O
InChI=1SC16H17FN2O4c1218911(16(21)22)15(20)10712(17)14(813(10)18)1935236419h79H26H21H3(H2122)
BBL003186
Synonyms: 1-ethyl-6-fluoro-4-oxo-7-(piperidin-1-yl)-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCCCC1)c(c2)F
CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCCCC1)c(c2)F
ZINC16677382
1ETHYL6FLUORO4OXO7(PIPERIDIN1YL)14DIHYDROQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO4OXO7PIPERIDIN1YL14DIHYDROQUINOLINE3CARBOXYLICACID
70459028
1ethyl6fluoro4oxo7piperidin1ylquinoline3carboxylicacid
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCC3)F)C(=O)O
InChI=1SC17H19FN2O3c12191012(17(22)23)16(21)11813(18)15(914(11)19)206435720h810H27H21H3(H2223)
BBL003187
Synonyms: 1'-methylspiro[chromene-2,4'-piperidin]-4(3H)-one
Smiles: CN1CCC2(CC1)CC(=O)c1c(O2)cccc1
CN1CCC2(CC1)CC(=O)c1c(O2)cccc1
NMETHYLSPIRO(2H1BENZOPYRAN24PIPERIDINE)4(3H)ONE
ZINC4383922
11METHYLSPIRO(CHROMANE24PIPERIDINE)4ONE
1METHYL34DIHYDROSPIRO(1BENZOPYRAN24PIPERIDINE)4ONE
1METHYLSPIRO(3HCHROMENE24PIPERIDINE)4ONE
1METHYLSPIRO(CHROMENE24PIPERIDIN)4(3H)ONE
23DIHYDRO1METHYL4OXOSPIRO(4HCHROMENE24PIPERIDINE)
34DIHYDRO1METHYLSPIRO(2H1BENZOPYRAN24PIPERIDIN)4ONE
BBL003188
Synonyms: (2E)-2-(1H-benzimidazol-2-yl)-3-(1,3-benzodioxol-5-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc2c(c1)OCO2)/c1nc2c([nH]1)cccc2
N#CC(=Cc1ccc2c(c1)OCO2)c1nc2c((nH)1)cccc2
ZINC03898329
ZINC3898329
(2E)2(1HBENZIMIDAZOL2YL)3(13BENZODIOXOL5YL)PROP2ENENITRILE
(2E)3(2HBENZO(34D)13DIOXOLAN5YL)2BENZIMIDAZOL2YLPROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(13BENZODIOXOL5YL)PROP2ENENITRILE
1157954669
2(1HBENZIMIDAZOL2YL)3(13BENZODIOXOL5YL)ACRYLONITRILE
3BENZO(13)DIOXOL5YL2(1HBENZOIMIDAZOL2YL)ACRYLONITRILE
C1OC2=C(O1)C=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4N3
InChI=1SC17H11N3O2c18912(171913312414(13)2017)711561516(811)22102115h18H10H2(H1920)b127+
BBL003189
Synonyms: (2E,6E)-2-benzylidene-6-(4-nitrobenzylidene)cyclohexanone
Smiles: O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/CCC/C/1=C\c1ccccc1
O=C1C(=Cc2ccc(cc2)(N+)(=O)(O))CCCC1=Cc1ccccc1
ZINC05259223
ZINC5259223
(2E6E)2BENZYLIDENE6((4NITROPHENYL)METHYLIDENE)CYCLOHEXAN1ONE
(2E6E)2BENZYLIDENE6(4NITROBENZYLIDENE)CYCLOHEXANONE
2(4NITROBENZYLIDENE)6BENZYLIDENECYCLOHEXANONE
C1CC(=CC2=CC=CC=C2)C(=O)C(=CC3=CC=C(C=C3)(N+)(=O)(O))C1
InChI=1SC20H17NO3c222017(13155213615)74818(20)141691119(121016)21(23)24h1356914H478H2b1713+1814+
BBL003190
Synonyms: (9E)-9-(4-chlorobenzylidene)-5-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: Clc1ccc(cc1)/C=C/1\CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)Cl
Clc1ccc(cc1)C=C1CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)Cl
(9E)9(4chlorobenzylidene)5(4chlorophenyl)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
(9E)5(4chlorophenyl)9((4chlorophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
C1CC(=CC2=CC=C(C=C2)Cl)C3=C(C1)C(N4C(=O)CSC4=N3)C5=CC=C(C=C5)Cl
InChI=1SC23H18Cl2N2OSc24178414(5917)12162131921(16)262327(20(28)132923)22(19)1561018(25)11715h41222H1313H2b1612+
BBL003191
Synonyms: (9E)-9-(4-bromobenzylidene)-5-(4-bromophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: Brc1ccc(cc1)/C=C/1\CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)Br
Brc1ccc(cc1)C=C1CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)Br
(9E)9(4bromobenzylidene)5(4bromophenyl)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
(9E)5(4bromophenyl)9((4bromophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
C1CC(=CC2=CC=C(C=C2)Br)C3=C(C1)C(N4C(=O)CSC4=N3)C5=CC=C(C=C5)Br
InChI=1SC23H18Br2N2OSc24178414(5917)12162131921(16)262327(20(28)132923)22(19)1561018(25)11715h41222H1313H2b1612+
BBL003192
Synonyms: (9E)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)OC(F)F)F
FC(Oc1ccc(cc1)C=C1CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)OC(F)F)F
(9E)9(4(difluoromethoxy)benzylidene)5(4(difluoromethoxy)phenyl)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
(9E)5(4(difluoromethoxy)phenyl)9((4(difluoromethoxy)phenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
C1CC(=CC2=CC=C(C=C2)OC(F)F)C3=C(C1)C(N4C(=O)CSC4=N3)C5=CC=C(C=C5)OC(F)F
InChI=1SC25H20F4N2O3Sc2623(27)33178414(5917)12162131921(16)302531(20(32)133525)22(19)1561018(11715)3424(28)29h4122224H1313H2b1612+
BBL003193
Synonyms: 7-(4-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: COc1ccc(cc1)C1N2C(=O)CSC2=NC2=C1CCc1c2cccc1
COc1ccc(cc1)C1N2C(=O)CSC2=NC2=C1CCc1c2cccc1
(7R)7(4METHOXYPHENYL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(7S)7(4METHOXYPHENYL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
157282774
7(4METHOXYPHENYL)10THIA7A11DIAZA67DIHYDRO5HCYCLOPENTA(B)PHENANTHRENE8(9H)ONE
7(4METHOXYPHENYL)57DIHYDRO6H10THIA7A11DIAZACYCLOPENTA(B)PHENANTHREN8ONE
7(4METHOXYPHENYL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
BBL003194
Synonyms: (2Z,6E)-2,6-dibenzylidene-4-tert-butylcyclohexanone
Smiles: CC(C1C/C(=C/c2ccccc2)/C(=O)/C(=C/c2ccccc2)/C1)(C)C
CC(C1CC(=Cc2ccccc2)C(=O)C(=Cc2ccccc2)C1)(C)C
(2Z6E)26DIBENZYLIDENE4TERTBUTYLCYCLOHEXANONE
ZINC2379832
(2Z6E)26dibenzylidene4tertbutylcyclohexan1one
CC(C)(C)C1CC(=CC2=CC=CC=C2)C(=O)C(=CC3=CC=CC=C3)C1
InChI=1SC24H26Oc124(23)221620(1418106471118)23(25)21(1722)1519128591319h41522H1617H213H3b20142115+
BBL003195
Synonyms: ethyl2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-1',10b'-dihydro-1H-spiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]-1-carboxylate
Smiles: CCOC(=O)N1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc2c(c1)OCCO2
CCOC(=O)N1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc2c(c1)OCCO2
ETHYL2(23DIHYDRO14BENZODIOXIN6YL)110BDIHYDRO1HSPIRO(PIPERIDINE45PYRAZOLO(15C)(13)BENZOXAZINE)1CARBOXYLATE
ethyl2(23dihydro14benzodioxin6yl)spiro(110bdihydropyrazolo(15c)(13)benzoxazine54piperidine)1carboxylate
CCOC(=O)N1CCC2(CC1)N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6O2
InChI=1SC25H27N3O5c123024(29)2711925(101227)2820(18534621(18)3325)1619(2628)17782223(1517)3214133122h381520H291416H21H3
BBL003196
Synonyms: (8Z)-8-(4-bromobenzylidene)-4-(4-bromophenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Smiles: Brc1ccc(cc1)/C=C\1/CCCC2=C1NC(=S)NC2c1ccc(cc1)Br
Brc1ccc(cc1)C=C1CCCC2=C1NC(=S)NC2c1ccc(cc1)Br
(8Z)8(4bromobenzylidene)4(4bromophenyl)345678hexahydroquinazoline2(1H)thione
(8Z)4(4bromophenyl)8((4bromophenyl)methylidene)134567hexahydroquinazoline2thione
C1CC(=CC2=CC=C(C=C2)Br)C3=C(C1)C(NC(=S)N3)C4=CC=C(C=C4)Br
InChI=1SC21H18Br2N2Sc22168413(5916)12152131819(2421(26)2520(15)18)1461017(23)11714h41219H13H2(H2242526)b1512
BBL003197
Synonyms: (8E)-8-[2-(difluoromethoxy)benzylidene]-4-[2-(difluoromethoxy)phenyl]-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Smiles: FC(Oc1ccccc1/C=C/1\CCCC2=C1NC(=S)NC2c1ccccc1OC(F)F)F
FC(Oc1ccccc1C=C1CCCC2=C1NC(=S)NC2c1ccccc1OC(F)F)F
(8E)8(2(difluoromethoxy)benzylidene)4(2(difluoromethoxy)phenyl)345678hexahydroquinazoline2(1H)thione
(8E)4(2(difluoromethoxy)phenyl)8((2(difluoromethoxy)phenyl)methylidene)134567hexahydroquinazoline2thione
C1CC(=CC2=CC=CC=C2OC(F)F)C3=C(C1)C(NC(=S)N3)C4=CC=CC=C4OC(F)F
InChI=1SC23H20F4N2O2Sc2421(25)30171031613(17)12147591619(14)2823(32)2920(16)158241118(15)3122(26)27h146810122022H579H2(H2282932)b1412+
BBL003198
Synonyms: N,N-dimethyl[4-(4-methylphenyl)-2-thioxo-1,2,3,4,5,6,7,8-octahydroquinazolin-8-yl]methanaminium
Smiles: C[NH+](CC1CCCC2=C1NC(=S)NC2c1ccc(cc1)C)C
C(NH+)(CC1CCCC2=C1NC(=S)NC2c1ccc(cc1)C)C
NNdimethyl(4(4methylphenyl)2thioxo12345678octahydroquinazolin8yl)methanaminium
dimethyl((4(4methylphenyl)2sulfanylidene345678hexahydro1Hquinazolin8yl)methyl)azanium
CC1=CC=C(C=C1)C2C3=C(C(CCC3)C(NH+)(C)C)NC(=S)N2
InChI=1SC18H25N3Sc1127913(10812)161564514(1121(2)3)17(15)2018(22)1916h7101416H4611H213H3(H2192022)p+1
BBL003199
Synonyms: methyl{2-[1-cyano-2-(4-methoxyphenyl)ethyl]-1H-benzimidazol-1-yl}acetate
Smiles: COc1ccc(cc1)CC(c1nc2c(n1CC(=O)OC)cccc2)C#N
COc1ccc(cc1)CC(c1nc2c(n1CC(=O)OC)cccc2)C#N
METHYL(2(1CYANO2(4METHOXYPHENYL)ETHYL)1HBENZIMIDAZOL1YL)ACETATE
BBL003200
Synonyms: ethyl(9Z)-9-benzylidene-3-methyl-5-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline-2-carboxylate
Smiles: CCOC(=O)c1sc2=NC3=C(C(n2c1C)c1ccccc1)CCC/C/3=C/c1ccccc1
CCOC(=O)c1sc2=NC3=C(C(n2c1C)c1ccccc1)CCCC3=Cc1ccccc1
ethyl(9Z)9benzylidene3methyl5phenyl6789tetrahydro5H(13)thiazolo(23b)quinazoline2carboxylate
ethyl(9Z)9benzylidene3methyl5phenyl5678tetrahydro(13)thiazolo(23b)quinazoline2carboxylate
CCOC(=O)C1=C(N2C(C3=C(C(=CC4=CC=CC=C4)CCC3)N=C2S1)C5=CC=CC=C5)C
InChI=1SC27H26N2O2Sc133126(30)2518(2)2924(20138591420)2216101521(23(22)2827(29)3225)1719116471219h4911141724H3101516H212H3b2117
BBL003201
Synonyms: ethyl(9Z)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-3,7-dimethyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline-2-carboxylate
Smiles: CCOC(=O)c1sc2=NC3=C(C(n2c1C)c1ccc(cc1)F)CC(C/C/3=C/c1ccc(cc1)F)C
CCOC(=O)c1sc2=NC3=C(C(n2c1C)c1ccc(cc1)F)CC(CC3=Cc1ccc(cc1)F)C
ethyl(9Z)9(4fluorobenzylidene)5(4fluorophenyl)37dimethyl6789tetrahydro5H(13)thiazolo(23b)quinazoline2carboxylate
ethyl(9Z)5(4fluorophenyl)9((4fluorophenyl)methylidene)37dimethyl5678tetrahydro(13)thiazolo(23b)quinazoline2carboxylate
CCOC(=O)C1=C(N2C(C3=C(C(=CC4=CC=C(C=C4)F)CC(C3)C)N=C2S1)C5=CC=C(C=C5)F)C
InChI=1SC28H26F2N2O2Sc143427(33)2617(3)3225(1971122(30)12819)231416(2)1320(24(23)3128(32)3526)15185921(29)10618h512151625H41314H213H3b2015
BBL003202
Synonyms: ethyl5-(4-chlorophenyl)-3-methyl-7-(4-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylate
Smiles: CCOC(=O)c1sc2=NC(=CC(n2c1C)c1ccc(cc1)Cl)c1ccc(cc1)C
CCOC(=O)c1sc2=NC(=CC(n2c1C)c1ccc(cc1)Cl)c1ccc(cc1)C
ETHYL5(4CHLOROPHENYL)3METHYL7(4METHYLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE2CARBOXYLATE
CCOC(=O)C1=C(N2C(C=C(N=C2S1)C3=CC=C(C=C3)C)C4=CC=C(C=C4)Cl)C
InChI=1SC23H21ClN2O2Sc142822(27)2115(3)2620(1791118(24)121017)1319(2523(26)2921)167514(2)6816h51320H4H213H3
BBL003203
Synonyms: 1-[(8E)-8-(4-methoxybenzylidene)-4-(4-methoxyphenyl)-2-thioxo-1,3,4,5,7,8-hexahydropyrido[4,3-d]pyrimidin-6(2H)-yl]ethanone
Smiles: COc1ccc(cc1)/C=C/1\CN(CC2=C1NC(=S)NC2c1ccc(cc1)OC)C(=O)C
COc1ccc(cc1)C=C1CN(CC2=C1NC(=S)NC2c1ccc(cc1)OC)C(=O)C
1((8E)8(4methoxybenzylidene)4(4methoxyphenyl)2thioxo134578hexahydropyrido(43d)pyrimidin6(2H)yl)ethanone
1((8E)4(4methoxyphenyl)8((4methoxyphenyl)methylidene)2sulfanylidene3457tetrahydro1Hpyrido(43d)pyrimidin6yl)ethanone
CC(=O)N1CC(=CC2=CC=C(C=C2)OC)C3=C(C1)C(NC(=S)N3)C4=CC=C(C=C4)OC
InChI=1SC24H25N3O3Sc115(28)271318(12164819(292)9516)2321(1427)22(2524(31)2623)1761020(303)11717h41222H1314H213H3(H2252631)b1812+
BBL003204
Synonyms: (8E)-8-benzylidene-6-methyl-4-phenyl-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidine-2(1H)-thione
Smiles: S=C1NC(c2ccccc2)C2=C(N1)/C(=C/c1ccccc1)/CN(C2)C
S=C1NC(c2ccccc2)C2=C(N1)C(=Cc1ccccc1)CN(C2)C
(8E)8benzylidene6methyl4phenyl345678hexahydropyrido(43d)pyrimidine2(1H)thione
BBL003205
Synonyms: (9E)-9-(4-methoxybenzylidene)-5-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: COc1ccc(cc1)/C=C/1\CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)OC
COc1ccc(cc1)C=C1CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)OC
(9E)9(4methoxybenzylidene)5(4methoxyphenyl)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
67533975
(9E)5(4methoxyphenyl)9((4methoxyphenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
COC1=CC=C(C=C1)C=C2CCCC3=C2N=C4N(C3C5=CC=C(C=C5)OC)C(=O)CS4
InChI=1SC25H24N2O3Sc1291910616(71119)14184352123(18)262527(22(28)153125)24(21)1781220(302)13917h61424H3515H212H3b1814+
BBL003206
Synonyms: (9E)-9-benzylidene-5-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: O=C1CSC2=NC3=C(C(N12)c1ccccc1)CCC/C/3=C\c1ccccc1
O=C1CSC2=NC3=C(C(N12)c1ccccc1)CCCC3=Cc1ccccc1
(9E)9benzylidene5phenyl6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
(9E)9benzylidene5phenyl5678tetrahydro(13)thiazolo(23b)quinazolin3one
C1CC(=CC2=CC=CC=C2)C3=C(C1)C(N4C(=O)CSC4=N3)C5=CC=CC=C5
InChI=1SC23H20N2OSc2620152723242118(14168314916)1271319(21)22(25(20)23)17105261117h168111422H7121315H2b1814+
BBL003207
Synonyms: (9E)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: Fc1ccc(cc1)/C=C/1\CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)F
Fc1ccc(cc1)C=C1CCCC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)F
(9E)9(4fluorobenzylidene)5(4fluorophenyl)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
(9E)5(4fluorophenyl)9((4fluorophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
C1CC(=CC2=CC=C(C=C2)F)C3=C(C1)C(N4C(=O)CSC4=N3)C5=CC=C(C=C5)F
InChI=1SC23H18F2N2OSc24178414(5917)12162131921(16)262327(20(28)132923)22(19)1561018(25)11715h41222H1313H2b1612+
BBL003208
Synonyms: (9E)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-7-methyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: Fc1ccc(cc1)/C=C/1\CC(C)CC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)F
Fc1ccc(cc1)C=C1CC(C)CC2=C1N=C1SCC(=O)N1C2c1ccc(cc1)F
(9E)9(4fluorobenzylidene)5(4fluorophenyl)7methyl6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
(9E)5(4fluorophenyl)9((4fluorophenyl)methylidene)7methyl5678tetrahydro(13)thiazolo(23b)quinazolin3one
CC1CC(=CC2=CC=C(C=C2)F)C3=C(C1)C(N4C(=O)CSC4=N3)C5=CC=C(C=C5)F
InChI=1SC24H20F2N2OSc1141017(12152618(25)7315)2220(1114)23(164819(26)9516)2821(29)133024(28)2722h29121423H101113H21H3b1712+
BBL003209
Synonyms: (8E)-8-(4-fluorobenzylidene)-4-(4-fluorophenyl)-6-methyl-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Smiles: Fc1ccc(cc1)/C=C/1\CC(C)CC2=C1NC(=S)NC2c1ccc(cc1)F
Fc1ccc(cc1)C=C1CC(C)CC2=C1NC(=S)NC2c1ccc(cc1)F
(8E)8(4fluorobenzylidene)4(4fluorophenyl)6methyl345678hexahydroquinazoline2(1H)thione
(8E)4(4fluorophenyl)8((4fluorophenyl)methylidene)6methyl134567hexahydroquinazoline2thione
CC1CC(=CC2=CC=C(C=C2)F)C3=C(C1)C(NC(=S)N3)C4=CC=C(C=C4)F
InChI=1SC22H20F2N2Sc1131016(12142617(23)7314)2119(1113)20(2522(27)2621)154818(24)9515h29121320H1011H21H3(H2252627)b1612+
BBL003210
Synonyms: (2Z)-2-(1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile
Smiles: COc1ccc(cc1)/C=C(\c1nc2c(s1)cccc2)/C#N
COc1ccc(cc1)C=C(c1nc2c(s1)cccc2)C#N
ZINC13618713
(2Z)2(13BENZOTHIAZOL2YL)3(4METHOXYPHENYL)PROP2ENENITRILE
(E)2(BENZOTHIAZOL2YL)3(4METHOXYPHENYL)ACRYLONITRILE
(Z)2(13BENZOTHIAZOL2YL)3(4METHOXYPHENYL)PROP2ENENITRILE
2(BENZOTHIAZOLE2YL)3(4METHOXYPHENYL)ACRYLONITRILE
ALPHA((Z)4METHOXYBENZYLIDENE)BENZOTHIAZOLE2ACETONITRILE
COC1=CC=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3S2
InChI=1SC17H12N2OSc120148612(7914)1013(1118)171915423516(15)2117h210H1H3b1310
BBL003211
Synonyms: N-(4-methylphenyl)-2-[5-oxo-7-(phenylcarbonyl)-2,3,5,6-tetrahydro-1H-pyrrolo[1,2-a]imidazol-6-yl]acetamide
Smiles: O=C(CC1C(=O)N2C(=C1C(=O)c1ccccc1)NCC2)Nc1ccc(cc1)C
O=C(CC1C(=O)N2C(=C1C(=O)c1ccccc1)NCC2)Nc1ccc(cc1)C
N(4methylphenyl)2(5oxo7(phenylcarbonyl)2356tetrahydro1Hpyrrolo(12a)imidazol6yl)acetamide
848179180
BBL003212
Synonyms: 1'-methyl-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-amine
Smiles: CN1CCC2(CC1)CC(N)c1c(O2)cccc1
CN1CCC2(CC1)CC(N)c1c(O2)cccc1
1METHYL34DIHYDROSPIRO(CHROMENE24PIPERIDIN)4AMINE
1METHYLSPIRO(34DIHYDROCHROMENE24PIPERIDINE)4AMINE
1METHYLSPIRO(CHROMAN24PIPERIDIN)4AMINE
70505907
BBL003213
Synonyms: 1-(1,2-diphenylcyclopropyl)methanamine
Smiles: NCC1(CC1c1ccccc1)c1ccccc1
NCC1(CC1c1ccccc1)c1ccccc1
1(12DIPHENYLCYCLOPROPYL)METHANAMINE
(12diphenylcyclopropyl)methanamine
C1C(C1(CN)C2=CC=CC=C2)C3=CC=CC=C3
InChI=1SC16H17Nc171216(1495261014)1115(16)137314813h11015H111217H2
BBL003214
Synonyms: 1-(1H-benzimidazol-2-yl)-2-[3-(difluoromethoxy)-4-methoxyphenyl]cyclopropanecarbonitrile
Smiles: COc1ccc(cc1OC(F)F)C1CC1(C#N)c1nc2c([nH]1)cccc2
COc1ccc(cc1OC(F)F)C1CC1(C#N)c1nc2c((nH)1)cccc2
1(1HBENZIMIDAZOL2YL)2(3(DIFLUOROMETHOXY)4METHOXYPHENYL)CYCLOPROPANECARBONITRILE
BBL003215
Synonyms: N-(2,5-dimethylphenyl)-2-[5-oxo-7-(phenylcarbonyl)-2,3,5,6-tetrahydro-1H-pyrrolo[1,2-a]imidazol-6-yl]acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CC1C(=O)N2C(=C1C(=O)c1ccccc1)NCC2
O=C(Nc1cc(C)ccc1C)CC1C(=O)N2C(=C1C(=O)c1ccccc1)NCC2
N(25dimethylphenyl)2(5oxo7(phenylcarbonyl)2356tetrahydro1Hpyrrolo(12a)imidazol6yl)acetamide
BBL003216
Synonyms: 1,2-diphenylcyclopropanecarboxylicacid
Smiles: OC(=O)C1(CC1c1ccccc1)c1ccccc1
OC(=O)C1(CC1c1ccccc1)c1ccccc1
10224132
12DIPHENYLCYCLOPROPANE1CARBOXYLICACID
12DIPHENYLCYCLOPROPANECARBOXYLICACID
C1C(C1(C2=CC=CC=C2)C(=O)O)C3=CC=CC=C3
InChI=1SC16H14O2c1715(18)16(1395261013)1114(16)127314812h11014H11H2(H1718)
BBL003217
Synonyms: 1-(1H-benzimidazol-2-yl)-2-phenylcyclopropanecarboxylicacid
Smiles: OC(=O)C1(CC1c1ccccc1)c1nc2c([nH]1)cccc2
OC(=O)C1(CC1c1ccccc1)c1nc2c((nH)1)cccc2
1(1HBENZIMIDAZOL2YL)2PHENYLCYCLOPROPANECARBOXYLICACID
929974732
1(1Hbenzimidazol2yl)2phenylcyclopropane1carboxylicacid
C1C(C1(C2=NC3=CC=CC=C3N2)C(=O)O)C4=CC=CC=C4
InChI=1SC17H14N2O2c2016(21)17(1012(17)116213711)151813845914(13)1915h1912H10H2(H1819)(H2021)
BBL003218
Synonyms: spiro[chromene-2,4'-piperidin]-4(3H)-one
Smiles: O=C1CC2(CCNCC2)Oc2c1cccc2
O=C1CC2(CCNCC2)Oc2c1cccc2
SPIRO(2H1BENZOPYRAN24PIPERIDIN)4(3H)ONE
SPIRO(3HCHROMENE24PIPERIDINE)4ONE
SPIRO(CHROMAN24PIPERIDIN)4ONE
SPIRO(CHROMAN24PIPERIDINE)4ONE
SPIRO(CHROMAN24PIPERIDINE)4ONEHCLSALT
SPIRO(CHROMANE24PIPERIDIN)4ONE
SPIRO(CHROMANE24PIPERIDINE)4ONE
SPIRO(CHROMENE24PIPERIDIN)4(3H)ONE
SPIRO(CHROMENE24PIPERIDIN)4ONE
ZINC2455949
136081840
34DIHYDROSPIRO((2H)1BENZOPYRAN24PIPERIDINE)4ONE
3HSPIRO(1BENZOPYRAN24PIPERIDINE)4ONE
BBL003219
Synonyms: (2E,6E)-2,6-bis(4-fluorobenzylidene)cyclohexanone
Smiles: O=C1/C(=C/c2ccc(cc2)F)/CCC/C/1=C\c1ccc(cc1)F
O=C1C(=Cc2ccc(cc2)F)CCCC1=Cc1ccc(cc1)F
ZINC04482197
ZINC38733074
ZINC4482197
(2E)26BIS(4FLUOROBENZYLIDENE)CYCLOHEXANONE
(2E6E)26BIS((4FLUOROPHENYL)METHYLIDENE)CYCLOHEXAN1ONE
(2E6E)26BIS(4FLUOROBENZYLIDENE)CYCLOHEXANONE
26BIS((4FLUOROPHENYL)METHYLENE)CYCLOHEXAN1ONE
26BIS((E)(4FLUOROPHENYL)METHYLIDENE)CYCLOHEXANONE
26BIS((E)4FLUOROBENZYLIDENE)CYCLOHEXANONE
26BIS(4FLUOROBENZAL)CYCLOHEXANONE
26BIS(4FLUOROBENZYLIDENE)CYCLOHEXANONE
62085829
C1CC(=CC2=CC=C(C=C2)F)C(=O)C(=CC3=CC=C(C=C3)F)C1
InChI=1SC20H16F2Oc21188414(5918)121621317(20(16)23)131561019(22)11715h413H13H2b1612+1713+
BBL003220
Synonyms: (2-hydroxy-4-methoxyphenyl)(phenyl)methanone
Smiles: COc1ccc(c(c1)O)C(=O)c1ccccc1
COc1ccc(c(c1)O)C(=O)c1ccccc1
(2HYDROXY4METHOXYPHENYL)(PHENYL)METHANONE
(2HYDROXY4METHOXYPHENYL)PHENYLMETHANONE
131577
2BENZOYL5METHOXYPHENOL
2HYDROXY4METHOXYBENZOPHENONE
2HYDROXY4METHOXYPHENYLPHENYLKETONE
4METHOXY2HYDROXYBENZOPHENONE
4METHOXY2HYDROXYBENZOPHENONEBUTYRICACID
BENZOPHENONE2HYDROXY4METHOXY
BENZOPHENONE3
BENZOPHENONE3(BP3)
METHANONE(2HYDROXY4METHOXYPHENYL)PHENYL
MFCD00008387
OXIBENZONA
OXIBENZONUM
OXYBENZON
OXYBENZONE
OXYBENZONE(USANINN)
OXYBENZONE(USANUSPINN)
OXYBENZONE(USPINN)
OXYBENZONUM
OXYBENZONUM(INNLATIN)
SOLAQUIN
SOLAQUIN(SALTMIX)
ZINC000000136138
ZINC00136138
ZINC136138
COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
InChI=1SC14H12O3c117117812(13(15)911)14(16)105324610h2915H1H3
BBL003221
Synonyms: 2-(2-methylphenyl)-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccccc1N1C(=O)c2c(C1=O)cccc2
Cc1ccccc1N1C(=O)c2c(C1=O)cccc2
1HISOINDOLE13(2H)DIONE2(2METHYLPHENYL)
2(2METHYLPHENYL)1HISOINDOLE13(2H)DIONE
2(2METHYLPHENYL)BENZO(C)AZOLINE13DIONE
2(2METHYLPHENYL)ISOINDOLE13DIONE
2464337
2PHTHALIMIDOTOLUENE
N(2METHYLPHENYL)PHTHALIMIDE
NOTOLYLPHTHALIMIDE
PHTHALIMIDENOTOLYL
ZINC00050522
ZINC50522
CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C2=O
InChI=1SC15H11NO2c110625913(10)1614(17)11734812(11)15(16)18h29H1H3
BBL003222
Synonyms: 2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]aniline
Smiles: COc1cc(ccc1OC)c1noc(n1)c1ccccc1N
COc1cc(ccc1OC)c1noc(n1)c1ccccc1N
2(3(34DIMETHOXYPHENYL)124OXADIAZOL5YL)ANILINE
946745035
MFCD13176363
ZINC000008701892
ZINC08701892
ZINC8701892
COC1=C(C=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3N)OC
InChI=1SC16H15N3O3c120138710(914(13)212)151816(221915)11534612(11)17h39H17H212H3
BBL003223
Synonyms: 2-(chloromethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
Smiles: ClCc1nnc(o1)c1ccc(cc1)Cl
ClCc1nnc(o1)c1ccc(cc1)Cl
ZINC01081481
ZINC1081481
134OXADIAZOLE2(CHLOROMETHYL)5(4CHLOROPHENYL)
2(CHLOROMETHYL)5(4CHLOROPHENYL)134OXADIAZOLE
24068153
2CHLOROMETHYL5(4CHLOROPHENYL)(134)OXADIAZOLE
2CHLOROMETHYL5(4CHLOROPHENYL)134OXADIAZOLE
2CHLOROMETHYL5(4CHLOROPHENYL)134OXADIAZOLE98
5(CHLOROMETHYL)2(4CHLOROPHENYL)134OXADIAZOLE
C1=CC(=CC=C1C2=NN=C(O2)CCl)Cl
InChI=1SC9H6Cl2N2Oc105812139(148)6137(11)426h14H5H2
BBL003224
Synonyms: 4-methyl-2-[(methylsulfonyl)amino]-1,3-thiazole-5-carboxylicacid
Smiles: OC(=O)c1sc(nc1C)NS(=O)(=O)C
OC(=O)c1sc(nc1C)NS(=O)(=O)C
ZINC000004384205
ZINC4384205
MFCD06011074
129912216
2((METHYLSULFONYL)AMINO)4METHYLTHIAZOLE5CARBOXYLICACID
2(METHANESULFONAMIDO)4METHYL13THIAZOLE5CARBOXYLICACID
2METHANESULFONAMIDO4METHYL13THIAZOLE5CARBOXYLICACID
2METHANESULFONYLAMINO4METHYLTHIAZOLE5CARBOXYLICACID
4METHYL2((METHYLSULFONYL)AMINO)13THIAZOLE5CARBOXYLICACID
CC1=C(SC(=N1)NS(=O)(=O)C)C(=O)O
InChI=1SC6H8N2O4S2c134(5(9)10)136(73)814(211)12h12H3(H78)(H910)
BBL003225
Synonyms: 3-amino-N,N,2-trimethylbenzamide
Smiles: CN(C(=O)c1cccc(c1C)N)C
CN(C(=O)c1cccc(c1C)N)C
3AMINONN2TRIMETHYLBENZAMIDE
ZINC08703637
ZINC8703637
CC1=C(C=CC=C1N)C(=O)N(C)C
InChI=1SC10H14N2Oc178(10(13)12(2)3)5469(7)11h46H11H213H3
BBL003226
Synonyms: 2-(hydroxymethyl)-1H-isoindole-1,3(2H)-dione
Smiles: OCN1C(=O)c2c(C1=O)cccc2
OCN1C(=O)c2c(C1=O)cccc2
HYDROXYMETHYLPHTHALIMIDE
HYDROXYMETHYLPHTHALIMIDE(RELATED)
METHANOLPHTHALIMIDO
METHANOLPHTHALIMIDO(RELATED)
N(HYDROXYMETHY)PHTHALIMIDE
N(HYDROXYMETHYL)PHTALIMIDE
N(HYDROXYMETHYL)PHTHALIMIDE
NHYDROXYMETHYLPHTHALIMIDE
NMETHYLOLPHTHALIMIDE
(HYDROXYMETHYL)PHTHALIMIDE
(PHTHALIMID1YL)METHANOL
OXYMETHYLPHTHALIMIDE
PHTHALIMIDEN(HYDROXYMETHYL)
PHTHALIMIDOMETHANOL
PHTHALIMIDOMETHYLALCOHOL
ZINC00076113
ZINC76113
118296
1HISOINDOLE12(HYDROXYMETHYL)
1HISOINDOLE13(2H)DIONE2(HYDROXYMETHYL)
2(HYDROXYMETHYL)13ISOINDOLINEDIONE
2(HYDROXYMETHYL)1HISOINDOLE13(2H)DIONE
2(HYDROXYMETHYL)23DIHYDRO1HISOINDOLE13DIONE
2(HYDROXYMETHYL)BENZO(C)AZOLIDINE13DIONE
2(HYDROXYMETHYL)BENZO(C)AZOLINE13DIONE
2(HYDROXYMETHYL)ISOINDOLE13DIONE
2(HYDROXYMETHYL)ISOINDOLINE13DIONE
2HYDROXYMETHYLISOINDOLE13DIONE
C1=CC=C2C(=C1)C(=O)N(C2=O)CO
InChI=1SC9H7NO3c115108(12)631247(6)9(10)13h1411H5H2
BBL003227
Synonyms: 2-[2-(morpholin-4-yl)-2-oxoethoxy]benzaldehyde
Smiles: O=Cc1ccccc1OCC(=O)N1CCOCC1
O=Cc1ccccc1OCC(=O)N1CCOCC1
ZINC05175370
ZINC5175370
125418840
2(2(MORPHOLIN4YL)2OXOETHOXY)BENZALDEHYDE
2(2MORPHOLIN4YL2OXOETHOXY)BENZALDEHYDE
C1COCCN1C(=O)COC2=CC=CC=C2C=O
InChI=1SC13H15NO4c15911312412(11)181013(16)1457178614h149H5810H2
BBL003228
Synonyms: 2-amino-N,N-dimethylbenzenesulfonamide
Smiles: Nc1ccccc1S(=O)(=O)N(C)C
Nc1ccccc1S(=O)(=O)N(C)C
NNDIMETHYL2AMINOBENZENESULFONAMIDE
ZINC00873648
ZINC873648
2AMINONNDIMETHYLBENZENE1SULFONAMIDE
2AMINONNDIMETHYLBENZENESULFONAMIDE
2AMINO(NNDIMETHYL)PHENYLSULPHONAMIDE
54468869
BENZENESULFONAMIDE2AMINONNDIMETHYL
CN(C)S(=O)(=O)C1=CC=CC=C1N
InChI=1SC8H12N2O2Sc110(2)13(1112)864357(8)9h36H9H212H3
BBL003229
Synonyms: 1,3-oxazole-5-carboxylicacid
Smiles: OC(=O)c1cnco1
OC(=O)c1cnco1
OXAZOLE5CARBOXYLICACID
ZINC49632635
5OXAZOLECARBOXYLICACID
118994904
13OXAZOLE5CARBOXYLICACID
5CARBOXY13OXAZOLE
5CARBOXYOXAZOLE
C1=C(OC=N1)C(=O)O
InChI=1SC4H3NO3c64(7)315283h12H(H67)
BBL003230
Synonyms: (4-ethylpiperazin-1-yl)(piperidin-4-yl)methanone
Smiles: CCN1CCN(CC1)C(=O)C1CCNCC1
CCN1CCN(CC1)C(=O)C1CCNCC1
PIPERAZINE1ETHYL4(PIPERIDIN4YLCARBONYL)
ZINC19412337
(4ETHYLPIPERAZIN1YL)(PIPERIDIN4YL)METHANONE
(4ETHYLPIPERAZIN1YL)PIPERIDIN4YLMETHANONE
1ETHYL4(PIPERIDIN4YLCARBONYL)PIPERAZINE
728930834
CCN1CCN(CC1)C(=O)C2CCNCC2
InChI=1SC12H23N3Oc12147915(10814)12(16)1135136411h1113H210H21H3
BBL003231
Synonyms: 1-(4-fluorobenzyl)-2-methyl-1H-indole-3-carbaldehyde
Smiles: O=Cc1c(C)n(c2c1cccc2)Cc1ccc(cc1)F
O=Cc1c(C)n(c2c1cccc2)Cc1ccc(cc1)F
ZINC00337027
ZINC337027
INDOLE3CARBOXALDEHYDE1(4FLUOROBENZYL)2METHYL
1((4FLUOROPHENYL)METHYL)2METHYL1HINDOLE3CARBOXALDEHYDE
1((4FLUOROPHENYL)METHYL)2METHYLINDOLE3CARBALDEHYDE
1(4FLUOROBENZYL)2METHYL1HINDOLE3CARBALDEHYDE
1HINDOLE3CARBOXALDEHYDE1((4FLUOROPHENYL)METHYL)2METHYL
332922153
CC1=C(C2=CC=CC=C2N1CC3=CC=C(C=C3)F)C=O
InChI=1SC17H14FNOc11216(1120)15423517(15)19(12)10136814(18)9713h2911H10H21H3
BBL003232
Synonyms: [4-(dimethylsulfamoyl)-2-methylphenoxy]aceticacid
Smiles: OC(=O)COc1ccc(cc1C)S(=O)(=O)N(C)C
OC(=O)COc1ccc(cc1C)S(=O)(=O)N(C)C
ZINC26468547
(4(DIMETHYLSULFAMOYL)2METHYLPHENOXY)ACETICACID
29148956
ACETICACID(4((DIMETHYLAMINO)SULFONYL)2METHYLPHENOXY)
2(4(dimethylsulfamoyl)2methylphenoxy)aceticacid
CC1=C(C=CC(=C1)S(=O)(=O)N(C)C)OCC(=O)O
InChI=1SC11H15NO5Sc1869(18(1516)12(2)3)4510(8)17711(13)14h46H7H213H3(H1314)
BBL003233
Synonyms: 1-(3,4-dichlorobenzyl)-2-methyl-1H-indole-3-carbaldehyde
Smiles: O=Cc1c(C)n(c2c1cccc2)Cc1ccc(c(c1)Cl)Cl
O=Cc1c(C)n(c2c1cccc2)Cc1ccc(c(c1)Cl)Cl
ZINC00449260
ZINC449260
1((34DICHLOROPHENYL)METHYL)2METHYLINDOLE3CARBALDEHYDE
1(34DICHLOROBENZYL)2METHYL1HINDOLE3CARBALDEHYDE
1HINDOLE3CARBOXALDEHYDE1((34DICHLOROPHENYL)METHYL)2METHYL
92407880
CC1=C(C2=CC=CC=C2N1CC3=CC(=C(C=C3)Cl)Cl)C=O
InChI=1SC17H13Cl2NOc11114(1021)13423517(13)20(11)9126715(18)16(19)812h2810H9H21H3
BBL003234
Synonyms: 4,6-dimethylquinoline-2(1H)-thione
Smiles: Cc1ccc2c(c1)c(C)cc(=S)[nH]2
Cc1ccc2c(c1)c(C)cc(=S)(nH)2
ZINC00201933
ZINC201933
41957237
46DIMETHYL1HQUINOLINE2THIONE
46DIMETHYLQUINOLINE2(1H)THIONE
CC1=CC2=C(C=C1)NC(=S)C=C2C
InChI=1SC11H11NSc1734109(57)8(2)611(13)1210h36H12H3(H1213)
BBL003235
Synonyms: 1-(1H-pyrazol-4-yl)methanamine
Smiles: NCc1c[nH]nc1
NCc1c(nH)nc1
PYRAZOL4YLMETHYLAMINE
ZINC12351305
1(1HPYRAZOL4YL)METHANAMINE
(1HPYRAZOL4YL)METHANAMINE
1HPYRAZOL4YLMETHANAMINE
1HPYRAZOL4YLMETHYLAMINE
37599590
4(AMINOMETHYL)PYRAZOLE
4AMINOMETHYL1HPYRAZOLE
C1=C(C=NN1)CN
InChI=1SC4H7N3c51426734h23H15H2(H67)
BBL003236
Synonyms: 1,3-diazepane-2-thione
Smiles: S=C1NCCCCN1
S=C1NCCCCN1
ZINC05189755
ZINC5189755
NNTETRAMETHYLENETHIOUREA
HEXAHYDRO13DIAZEPIN2THIONE
HEXAHYDRO2H13DIAZEPIN2THIONE
HEXAHYDRO2H13DIAZEPINE2THIONE
13DIAZACYCLOHEPTANE2THIONE
13DIAZAPERHYDROEPINE2THIONE
13DIAZEPANE2THIONE
13DIAZEPIN2THIONEHEXAHYDRO
13DIAZIPANE2THIONE
2H13DIAZEPINE2THIONEHEXAHYDRO
5700049
C1CCNC(=S)NC1
InChI=1SC5H10N2Sc856312475h14H2(H2678)
BBL003237
Synonyms: 3-[4-(3,4-dihydroquinolin-1(2H)-ylsulfonyl)phenyl]propanoicacid
Smiles: OC(=O)CCc1ccc(cc1)S(=O)(=O)N1CCCc2c1cccc2
OC(=O)CCc1ccc(cc1)S(=O)(=O)N1CCCc2c1cccc2
ZINC5133102
1001572957
3(4(34DIHYDRO2HQUINOLIN1YLSULFONYL)PHENYL)PROPANOICACID
3(4(34DIHYDRO2HQUINOLINE1SULFONYL)PHENYL)PROPIONICACID
3(4(34DIHYDROQUINOLIN1(2H)YLSULFONYL)PHENYL)PROPANOICACID
C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)CCC(=O)O
InChI=1SC18H19NO4Sc2018(21)1291471016(11814)24(2223)19133515412617(15)19h124681011H3591213H2(H2021)
BBL003238
Synonyms: 1-[(5-fluoro-2-methoxyphenyl)sulfonyl]piperidine-3-carboxylicacid
Smiles: COc1ccc(cc1S(=O)(=O)N1CCCC(C1)C(=O)O)F
COc1ccc(cc1S(=O)(=O)N1CCCC(C1)C(=O)O)F
3PIPERIDINECARBOXYLICACID1((5FLUORO2METHOXYPHENYL)SULFONYL)
928709697
1((5FLUORO2METHOXYPHENYL)SULFONYL)PIPERIDINE3CARBOXYLICACID
1(5fluoro2methoxyphenyl)sulfonylpiperidine3carboxylicacid
COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCC(C2)C(=O)O
InChI=1SC13H16FNO5Sc120115410(14)712(11)21(1819)156239(815)13(16)17h4579H2368H21H3(H1617)
BBL003239
Synonyms: 1-(4-hydroxyquinazolin-2-yl)guanidine
Smiles: NC(=N)Nc1nc2ccccc2c(n1)O
NC(=N)Nc1nc2ccccc2c(n1)O
ZINC08553156
ZINC8553156
1(4HYDROXYQUINAZOLIN2YL)GUANIDINE
GUANIDINE(14DIHYDRO4OXO2QUINAZOLINYL)
N(4HYDROXYQUINAZOLIN2YL)GUANIDINE
N(4OXO34DIHYDRO2QUINAZOLINYL)GUANIDINE
N(4OXO34DIHYDROQUINAZOLIN2YL)GUANIDINE
1((2E)4OXO34DIHYDROQUINAZOLIN2(1H)YLIDENE)GUANIDINE
1(4OXO34DIHYDROQUINAZOLIN2YL)GUANIDINE
1(4OXO3HQUINAZOLIN2YL)GUANIDINE
2(4OXO1HQUINAZOLIN2YL)GUANIDINE
2GUANIDINO4(3H)QUINAZOLINONE
2GUANIDINOQUINAZOLINE4(3H)ONE
62936929
AMINO(4OXO(3HYDROQUINAZOLIN2YL))CARBOXAMIDINE
C1=CC=C2C(=C1)C(=O)N=C(N2)N=C(N)N
InChI=1SC9H9N5Oc108(11)14912642135(6)7(15)139h14H(H5101112131415)
BBL003240
Synonyms: 1H-benzotriazol-1-ylmethanol
Smiles: OCn1nnc2c1cccc2
OCn1nnc2c1cccc2
ZINC00126761
ZINC126761
(1HBENZO(D)(123)TRIAZOL1YL)METHANOL
1(HYDROXYMETHYL)1HBENZOTRIAZOLE
1(HYDROXYMETHYL)BENZOTRIAZOLE
123BENZOTRIAZOL1YLMETHANOL
1BENZOTRIAZOLEMETHANOL
1H123BENZOTRIAZOL1YLMETHANOL
1H123BENZOTRIAZOLE1METHANOL
1HBENZOTRIAZOL1YLMETHANOL
1HBENZOTRIAZOLE1METHANOL
1HBENZTRIAZOLE1METHANOL
1HYDROXYMETHYLBENZOTRIAZOLE
28539028
BENZOTRIAZOL1YLMETHANOL
BENZOTRIAZOLYLMETHAN1OL
C1=CC=C2C(=C1)N=NN2CO
InChI=1SC7H7N3Oc11510742136(7)8910h1411H5H2
BBL003241
Synonyms: 3-methyl-2-nitrobenzoicacid
Smiles: [O-][N+](=O)c1c(C)cccc1C(=O)O
(O)(N+)(=O)c1c(C)cccc1C(=O)O
2NITRO3METHYLBENZOICACID
3METHYL2NITROBENZOICACID
5437387
BENZOICACID3METHYL2NITRO
ZINC1733813
CC1=CC=CC(=C1(N+)(=O)(O))C(=O)O
InChI=1SC8H7NO4c153246(8(10)11)7(5)9(12)13h24H1H3(H1011)
BBL003242
Synonyms: 5,6-dibromo-2-(4-hydroxyphenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: BrC1CC2C(=O)N(C(=O)C2CC1Br)c1ccc(cc1)O
BrC1CC2C(=O)N(C(=O)C2CC1Br)c1ccc(cc1)O
2(4HYDROXYPHENYL)56DIBROMOOCTAHYDRO2HISOINDOLE13DIONE
56DIBROMO2(4HYDROXYPHENYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
56DIBROMO2(4HYDROXYPHENYL)HEXAHYDROISOINDOLE13DIONE
78650825
56dibromo2(4hydroxyphenyl)3a45677ahexahydroisoindole13dione
C1C2C(CC(C1Br)Br)C(=O)N(C2=O)C3=CC=C(C=C3)O
InChI=1SC14H13Br2NO3c15115910(612(11)16)14(20)17(13(9)19)7138(18)427h1491218H56H2
BBL003243
Synonyms: 4-[(2,3-dichlorophenyl)amino]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)Nc1cccc(c1Cl)Cl
OC(=O)CCC(=O)Nc1cccc(c1Cl)Cl
ZINC72393
198009846
3((23DICHLOROPHENYL)CARBAMOYL)PROPANOICACID
4((23DICHLOROPHENYL)AMINO)4OXOBUTANOICACID
4(23DICHLOROANILINO)4OXOBUTANOICACID
BUTANOICACID4((23DICHLOROPHENYL)AMINO)4OXO
C1=CC(=C(C(=C1)Cl)Cl)NC(=O)CCC(=O)O
InChI=1SC10H9Cl2NO3c1162137(10(6)12)138(14)459(15)16h13H45H2(H1314)(H1516)
BBL003244
Synonyms: 4-{[(E)-(4-methoxyphenyl)methylidene]amino}benzoicacid
Smiles: COc1ccc(cc1)/C=N/c1ccc(cc1)C(=O)O
COc1ccc(cc1)C=Nc1ccc(cc1)C(=O)O
4(((E)(4methoxyphenyl)methylidene)amino)benzoicacid
4380385
BBL003245
Synonyms: (2E)-2-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1cccn1c1ccc(cc1)Br
NC(=O)NN=Cc1cccn1c1ccc(cc1)Br
ZINC33328175
N((1E)2(1(4BROMOPHENYL)PYRROL2YL)1AZAVINYL)AMINOAMIDE
(2E)2((1(4BROMOPHENYL)1HPYRROL2YL)METHYLIDENE)HYDRAZINECARBOXAMIDE
124695267
((E)(1(4bromophenyl)pyrrol2yl)methylideneamino)urea
C1=CN(C(=C1)C=NNC(=O)N)C2=CC=C(C=C2)Br
InChI=1SC12H11BrN4Oc1393510(649)1771211(17)8151612(14)18h18H(H3141618)b158+
BBL003246
Synonyms: 4-chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide
Smiles: N#Cc1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C
N#Cc1c(NC(=O)c2ccc(cc2)Cl)sc(c1C)C
ZINC00557858
ZINC557858
(4CHLOROPHENYL)N(3CYANO45DIMETHYL(2THIENYL))CARBOXAMIDE
339125018
4CHLORON(3CYANO45DIMETHYL2THIENYL)BENZAMIDE
4CHLORON(3CYANO45DIMETHYLTHIOPHEN2YL)BENZAMIDE
CC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)Cl)C
InChI=1SC14H11ClN2OSc189(2)1914(12(8)716)1713(18)103511(15)6410h36H12H3(H1718)
BBL003247
Synonyms: ethyl4-{[(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
ETHYL4((((3AR4S4AR5AS6R6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)ACETYL)AMINO)BENZOATE
ETHYL4(((13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)ACETYL)AMINO)BENZOATE
1005069102
MFCD03037711
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC22H22N2O5c122922(28)113512(6411)2317(25)102420(26)18137814(16915(13)16)19(18)21(24)27h3813161819H2910H21H3(H2325)
BBL003248
Synonyms: ethyl5-hydroxy-2-methyl-1-(2-phenylethyl)-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)cc2)CCc1ccccc1
CCOC(=O)c1c(C)n(c2c1cc(O)cc2)CCc1ccccc1
ETHYL5HYDROXY2METHYL1(2PHENYLETHYL)1HINDOLE3CARBOXYLATE
333352684
5HYDROXY2METHYL1PHENETHYL1HINDOLE3CARBOXYLICACIDETHYLESTER
ETHYL5HYDROXY2METHYL1PHENETHYLINDOLE3CARBOXYLATE
ZINC04123757
ZINC4123757
ethyl5hydroxy2methyl1(2phenylethyl)indole3carboxylate
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCC3=CC=CC=C3)C
InChI=1SC20H21NO3c132420(23)1914(2)21(1211157546815)1810916(22)1317(18)19h4101322H31112H212H3
BBL003249
Synonyms: (1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)aceticacid(non-preferredname)
Smiles: OC(=O)CN1C(=O)C2C(C1=O)C1(Br)c3c(C2c2c1cccc2)cccc3
OC(=O)CN1C(=O)C2C(C1=O)C1(Br)c3c(C2c2c1cccc2)cccc3
(1bromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)aceticacid(nonpreferredname)
332024290
C1=CC=C2C(=C1)C3C4C(C2(C5=CC=CC=C35)Br)C(=O)N(C4=O)CC(=O)O
InChI=1SC20H14BrNO4c212012731510(12)15(11624813(11)20)1617(20)19(26)22(18(16)25)914(23)24h181517H9H2(H2324)
BBL003250
Synonyms: ethyl(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetate(non-preferredname)
Smiles: CCOC(=O)CN1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3
CCOC(=O)CN1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3
ethyl(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)acetate(nonpreferredname)
6299463
CCOC(=O)CN1C(=O)C2C(C1=O)C3C4=CC=CC=C4C2C5=CC=CC=C35
InChI=1SC22H19NO4c122716(24)112321(25)191712734813(12)18(20(19)22(23)26)151065914(15)17h3101720H211H21H3
BBL003251
Synonyms: 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-3-phenylpropanoicacid
Smiles: OC(=O)C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Cc1ccccc1
OC(=O)C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Cc1ccccc1
(2R)2((3AR4R4AR5AS6S6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)3PHENYLPROPANOICACID
2(13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)3PHENYLPROPANOICACID
381723826
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C(CC5=CC=CC=C5)C(=O)O
InChI=1SC20H19NO4c221816116712(14913(11)14)17(16)19(23)21(18)15(20(24)25)8104213510h171117H89H2(H2425)
BBL003252
Synonyms: (4Z)-4-(furan-2-ylmethylidene)-2-phenyl-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccco1)c1ccccc1
O=C1OC(=NC1=Cc1ccco1)c1ccccc1
ZINC04709175
ZINC4709175
5(4H)OXAZOLONE4(2FURANYLMETHYLENE)2PHENYL
5(4H)OXAZOLONE4(2FURANYLMETHYLENE)2PHENYL(4Z)
(4Z)4(2FURYLMETHYLENE)2PHENYLOXAZOL5ONE
(4Z)4(FURAN2YLMETHYLIDENE)2PHENYL13OXAZOL5(4H)ONE
(4Z)4(FURAN2YLMETHYLIDENE)2PHENYL13OXAZOL5ONE
15601475
2PHENYL4((ALPHAZ)FURFURYLIDENE)OXAZOLE5(4H)ONE
2PHENYL4FURFURYLIDENEOXAZOLE5(4H)ONE
4(2FURYLMETHYLENE)2PHENYL13OXAZOL5(4H)ONE
4FURAN2YLMETHYLENE2PHENYL4HOXAZOL5ONE
C1=CC=C(C=C1)C2=NC(=CC3=CC=CO3)C(=O)O2
InChI=1SC14H9NO3c161412(9117481711)1513(1814)105213610h19Hb129
BBL003253
Synonyms: N-[(5-fluoro-2-methoxyphenyl)sulfonyl]-N-methylglycine
Smiles: COc1ccc(cc1S(=O)(=O)N(CC(=O)O)C)F
COc1ccc(cc1S(=O)(=O)N(CC(=O)O)C)F
GLYCINEN((5FLUORO2METHOXYPHENYL)SULFONYL)NMETHYL
928709777
N((5FLUORO2METHOXYPHENYL)SULFONYL)NMETHYLGLYCINE
ZINC34776318
2((5fluoro2methoxyphenyl)sulfonylmethylamino)aceticacid
CN(CC(=O)O)S(=O)(=O)C1=C(C=CC(=C1)F)OC
InChI=1SC10H12FNO5Sc112(610(13)14)18(1516)957(11)348(9)172h35H6H212H3(H1314)
BBL003254
Synonyms: N'-(7-chloroquinolin-4-yl)-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1ccnc2c1ccc(c2)Cl)CC
CCN(CCNc1ccnc2c1ccc(c2)Cl)CC
(7CHLORO4QUINOLINYL)(2(DIETHYLAMINO)ETHYL)AMINE
108841812
2((7CHLORO4QUINOLYL)AMINO)ETHYLDIETHYLAMINE
N(7CHLORANYLQUINOLIN4YL)NNDIETHYLETHANE12DIAMINE
N(7CHLORO4QUINOLINYL)NNDIETHYLETHANE12DIAMINE
N(7CHLOROQUINOLIN4YL)NNDIETHYLETHANE12DIAMINE
ZINC6792
CCN(CC)CCNC1=C2C=CC(=CC2=NC=C1)Cl
InChI=1SC15H20ClN3c1319(42)10918147817151112(16)5613(14)15h5811H34910H212H3(H1718)
BBL003255
Synonyms: N-ethyl-N-[(4-methoxy-3-methylphenyl)sulfonyl]glycine
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)C)OC)CC(=O)O
CCN(S(=O)(=O)c1ccc(c(c1)C)OC)CC(=O)O
1091565375
NETHYLN((4METHOXY3METHYLPHENYL)SULFONYL)GLYCINE
ZINC19929550
2(ethyl(4methoxy3methylphenyl)sulfonylamino)aceticacid
CCN(CC(=O)O)S(=O)(=O)C1=CC(=C(C=C1)OC)C
InChI=1SC12H17NO5Sc1413(812(14)15)19(1617)105611(183)9(2)710h57H48H213H3(H1415)
BBL003256
Synonyms: N-[(3-chloro-4-methoxyphenyl)sulfonyl]-N-ethylglycine
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)Cl)OC)CC(=O)O
CCN(S(=O)(=O)c1ccc(c(c1)Cl)OC)CC(=O)O
N((3CHLORO4METHOXYPHENYL)SULFONYL)NETHYLGLYCINE
ZINC19930014
((3CHLORO4METHOXYBENZENESULFONYL)ETHYLAMINO)ACETICACID
1091524069
2((3chloro4methoxyphenyl)sulfonylethylamino)aceticacid
CCN(CC(=O)O)S(=O)(=O)C1=CC(=C(C=C1)OC)Cl
InChI=1SC11H14ClNO5Sc1313(711(14)15)19(1617)84510(182)9(12)68h46H37H212H3(H1415)
BBL003257
Synonyms: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone
Smiles: O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)CSc1nnc(s1)N
O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)CSc1nnc(s1)N
ZINC19840618
2((5AMINO134THIADIAZOL2YL)SULFANYL)1(4(DIPHENYLMETHYL)PIPERAZIN1YL)ETHANONE
2((5AMINO134THIADIAZOL2YL)SULFANYL)1(4BENZHYDRYLPIPERAZIN1YL)ETHANONE
2(5AMINO(134THIADIAZOL2YLTHIO))1(4(DIPHENYLMETHYL)PIPERAZINYL)ETHAN1ONE
638999298
C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CSC4=NN=C(S4)N
InChI=1SC21H23N5OS2c2220232421(2920)281518(27)25111326(141225)19(167314816)1795261017h11019H1115H2(H22223)
BBL003258
Synonyms: 1-(3,5-dimethylphenyl)-3-[2-(trifluoromethyl)phenyl]urea
Smiles: O=C(Nc1ccccc1C(F)(F)F)Nc1cc(C)cc(c1)C
O=C(Nc1ccccc1C(F)(F)F)Nc1cc(C)cc(c1)C
ZINC51354202
1(35DIMETHYLPHENYL)3(2(TRIFLUOROMETHYL)PHENYL)UREA
897320104
CC1=CC(=CC(=C1)NC(=O)NC2=CC=CC=C2C(F)(F)F)C
InChI=1SC16H15F3N2Oc110711(2)912(810)2015(22)2114643513(14)16(1718)19h39H12H3(H2202122)
BBL003259
Synonyms: 5'-amino-3,4-dimethoxy-4''-methyl-1,1':3',1''-terphenyl-4',6'-dicarbonitrile
Smiles: N#Cc1c(cc(c(c1N)C#N)c1ccc(cc1)C)c1ccc(c(c1)OC)OC
N#Cc1c(cc(c(c1N)C#N)c1ccc(cc1)C)c1ccc(c(c1)OC)OC
5amino34dimethoxy4methyl1131terphenyl46dicarbonitrile
299443371
2AMINO4(34DIMETHOXYPHENYL)6(4METHYLPHENYL)BENZENE13DICARBONITRILE
ZINC02505852
ZINC2505852
CC1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)N)C#N)C3=CC(=C(C=C3)OC)OC
InChI=1SC23H19N3O2c1144615(7514)171118(20(1325)23(26)19(17)1224)168921(272)22(1016)283h411H26H213H3
BBL003260
Synonyms: (5Z)-3-butyl-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCN1C(=S)S/C(=C\c2ccc(c(c2)OCC)O)/C1=O
CCCCN1C(=S)SC(=Cc2ccc(c(c2)OCC)O)C1=O
(5Z)3BUTYL5((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3BUTYL5(3ETHOXY4HYDROXYBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
ZINC02706922
ZINC2706922
CCCCN1C(=O)C(=CC2=CC(=C(C=C2)O)OCC)SC1=S
InChI=1SC16H19NO3S2c13581715(19)14(2216(17)21)10116712(18)13(911)2042h6791018H358H212H3b1410
BBL003261
Synonyms: {(5Z)-4-oxo-5-[4-(propan-2-yl)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: CC(c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)O)C
CC(c1ccc(cc1)C=C1SC(=S)N(C1=O)CC(=O)O)C
ZINC13343660
((5Z)4OXO5(4(PROPAN2YL)BENZYLIDENE)2THIOXO13THIAZOLIDIN3YL)ACETICACID
313684536
2((5Z)4oxo5((4propan2ylphenyl)methylidene)2sulfanylidene13thiazolidin3yl)aceticacid
CC(C)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O
InChI=1SC15H15NO3S2c19(2)115310(4611)71214(19)16(813(17)18)15(20)2112h379H8H212H3(H1718)b127
BBL003262
Synonyms: N-ethyl-N-[(5-fluoro-2-methoxyphenyl)sulfonyl]glycine
Smiles: CCN(S(=O)(=O)c1cc(F)ccc1OC)CC(=O)O
CCN(S(=O)(=O)c1cc(F)ccc1OC)CC(=O)O
1192806011
NETHYLN((5FLUORO2METHOXYPHENYL)SULFONYL)GLYCINE
ZINC39315676
2(ethyl(5fluoro2methoxyphenyl)sulfonylamino)aceticacid
CCN(CC(=O)O)S(=O)(=O)C1=C(C=CC(=C1)F)OC
InChI=1SC11H14FNO5Sc1313(711(14)15)19(1617)1068(12)459(10)182h46H37H212H3(H1415)
BBL003263
Synonyms: ethyl6-tert-butyl-2-[(chloroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCl)sc2c1CCC(C2)C(C)(C)C
CCOC(=O)c1c(NC(=O)CCl)sc2c1CCC(C2)C(C)(C)C
ethyl6tertbutyl2((chloroacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
519016752
ethyl6tertbutyl2((2chloroacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)CCl
InChI=1SC17H24ClNO3Sc152216(21)14117610(17(23)4)812(11)2315(14)1913(20)918h10H59H214H3(H1920)
BBL003264
Synonyms: 3-{[4-(ethoxycarbonyl)phenyl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylicacid
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1C2C=CC(C1C(=O)O)C2
CCOC(=O)c1ccc(cc1)NC(=O)C1C2C=CC(C1C(=O)O)C2
2((4ETHOXYCARBONYLPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((4(ETHOXYCARBONYL)ANILINO)CARBONYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((4(ETHOXYCARBONYL)PHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
353514600
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3
InChI=1SC18H19NO5c122418(23)105713(8610)1916(20)14113412(911)15(14)17(21)22h3811121415H29H21H3(H1920)(H2122)
BBL003265
Synonyms: 5,6-dibromo-2-(2,4-dimethylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: BrC1CC2C(CC1Br)C(=O)N(C2=O)c1ccc(cc1C)C
BrC1CC2C(CC1Br)C(=O)N(C2=O)c1ccc(cc1C)C
56DIBROMO2(24DIMETHYLPHENYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
78650836
(3AR5S6R7AS)56DIBROMO2(24DIMETHYLPHENYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
56dibromo2(24dimethylphenyl)3a45677ahexahydroisoindole13dione
CC1=CC(=C(C=C1)N2C(=O)C3CC(C(CC3C2=O)Br)Br)C
InChI=1SC16H17Br2NO2c183414(9(2)58)1915(20)10612(17)13(18)711(10)16(19)21h351013H67H212H3
BBL003266
Synonyms: 5,6-dibromo-2-(2,5-dimethylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: BrC1CC2C(=O)N(C(=O)C2CC1Br)c1cc(C)ccc1C
BrC1CC2C(=O)N(C(=O)C2CC1Br)c1cc(C)ccc1C
(3AR5S6R7AS)56DIBROMO2(25DIMETHYLPHENYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
1005090185
56DIBROMO2(25DIMETHYLPHENYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
56dibromo2(25dimethylphenyl)3a45677ahexahydroisoindole13dione
CC1=CC(=C(C=C1)C)N2C(=O)C3CC(C(CC3C2=O)Br)Br
InChI=1SC16H17Br2NO2c18349(2)14(58)1915(20)10612(17)13(18)711(10)16(19)21h351013H67H212H3
BBL003267
Synonyms: pentyl2-(3-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Smiles: CCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C(=O)C
CCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C(=O)C
351995807
PENTYL2(3ACETYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
PENTYL2(3ACETYLPHENYL)13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
PENTYL2(3ACETYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
ZINC04113427
ZINC4113427
CCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC(=C3)C(=O)C
InChI=1SC22H21NO5c1345112822(27)169101819(1316)21(26)23(20(18)25)1786715(1217)14(2)24h6101213H3511H212H3
BBL003268
Synonyms: 2-[(4-chlorophenyl)sulfanyl]-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)CSc2ccc(cc2)Cl)sc(c1C)C
N#Cc1c(NC(=O)CSc2ccc(cc2)Cl)sc(c1C)C
ZINC04554538
ZINC4554538
2((4CHLOROPHENYL)SULFANYL)N(3CYANO45DIMETHYL2THIENYL)ACETAMIDE
2((4CHLOROPHENYL)SULFANYL)N(3CYANO45DIMETHYLTHIOPHEN2YL)ACETAMIDE
2((4CHLOROPHENYL)THIO)N(3CYANO45DIMETHYLTHIOPHEN2YL)ACETAMIDE
2(4CHLOROPHENYL)SULFANYLN(3CYANO45DIMETHYLTHIOPHEN2YL)ACETAMIDE
689743826
CC1=C(SC(=C1C#N)NC(=O)CSC2=CC=C(C=C2)Cl)C
InChI=1SC15H13ClN2OS2c1910(2)2115(13(9)717)1814(19)820125311(16)4612h36H8H212H3(H1819)
BBL003269
Synonyms: 4-formylphenyl3,5-di-tert-butylbenzoate
Smiles: O=Cc1ccc(cc1)OC(=O)c1cc(cc(c1)C(C)(C)C)C(C)(C)C
O=Cc1ccc(cc1)OC(=O)c1cc(cc(c1)C(C)(C)C)C(C)(C)C
ZINC01838908
ZINC1838908
(4FORMYLPHENYL)35DITERTBUTYLBENZOATE
328117368
4FORMYLPHENYL35BIS(TERTBUTYL)BENZOATE
4FORMYLPHENYL35DITERTBUTYLBENZOATE
CC(C)(C)C1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)C=O)C(C)(C)C
InChI=1SC22H26O3c121(23)171116(1218(1317)22(45)6)20(24)25199715(1423)81019h714H16H3
BBL003270
Synonyms: 1-[(4-ethoxyphenyl)sulfonyl]piperidine-4-carboxylicacid
Smiles: CCOc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)O
CCOc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)O
ZINC2619099
1((4ETHOXYPHENYL)SULFONYL)PIPERIDINE4CARBOXYLICACID
1(4ETHOXYBENZENESULFONYL)PIPERIDINE4CARBOXYLICACID
1(4ETHOXYPHENYL)SULFONYLPIPERIDINE4CARBOXYLICACID
1(4ETHOXYPHENYLSULFONYL)PIPERIDINE4CARBOXYLICACID
4PIPERIDINECARBOXYLICACID1((4ETHOXYPHENYL)SULFONYL)
757220863
CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)O
InChI=1SC14H19NO5Sc1220123513(6412)21(1819)159711(81015)14(16)17h3611H2710H21H3(H1617)
BBL003271
Synonyms: N-(4-bromo-3-chlorophenyl)-2-chloroacetamide
Smiles: ClCC(=O)Nc1ccc(c(c1)Cl)Br
ClCC(=O)Nc1ccc(c(c1)Cl)Br
22521433
N(4BROMO3CHLOROPHENYL)2CHLOROACETAMIDE
ZINC02566665
ZINC2566665
C1=CC(=C(C=C1NC(=O)CCl)Cl)Br
InChI=1SC8H6BrCl2NOc96215(37(6)11)128(13)410h13H4H2(H1213)
BBL003272
Synonyms: [2-methyl-4-(pyrrolidin-1-ylsulfonyl)phenoxy]aceticacid
Smiles: OC(=O)COc1ccc(cc1C)S(=O)(=O)N1CCCC1
OC(=O)COc1ccc(cc1C)S(=O)(=O)N1CCCC1
ZINC2875646
(2METHYL4(PYRROLIDIN1YLSULFONYL)PHENOXY)ACETICACID
(2METHYL4(PYRROLIDINE1SULFONYL)PHENOXY)ACETICACID
2(2METHYL4PYRROLIDIN1YLSULFONYLPHENOXY)ACETICACID
831188706
ACETICACID(2METHYL4(1PYRROLIDINYLSULFONYL)PHENOXY)
CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)O
InChI=1SC13H17NO5Sc110811(4512(10)19913(15)16)20(1718)14623714h458H23679H21H3(H1516)
BBL003273
Synonyms: 2-(3-formylphenoxy)acetamide
Smiles: O=Cc1cccc(c1)OCC(=O)N
O=Cc1cccc(c1)OCC(=O)N
ZINC09237520
ZINC9237520
2(3FORMYLPHENOXY)ACETAMIDE
3(AMINOCARBONYLMETHOXY)BENZALDEHYDE
849015958
C1=CC(=CC(=C1)OCC(=O)N)C=O
InChI=1SC9H9NO3c109(12)61383127(48)511h15H6H2(H21012)
BBL003274
Synonyms: 1-[(4-ethoxy-3-methylphenyl)sulfonyl]piperidine-3-carboxylicacid
Smiles: CCOc1ccc(cc1C)S(=O)(=O)N1CCCC(C1)C(=O)O
CCOc1ccc(cc1C)S(=O)(=O)N1CCCC(C1)C(=O)O
1((4ETHOXY3METHYLPHENYL)SULFONYL)PIPERIDINE3CARBOXYLICACID
1(4ETHOXY3METHYLBENZENESULFONYL)PIPERIDINE3CARBOXYLICACID
1(4ETHOXY3METHYLPHENYL)SULFONYLPIPERIDINE3CARBOXYLICACID
3PIPERIDINECARBOXYLICACID1((4ETHOXY3METHYLPHENYL)SULFONYL)
838884494
CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)O)C
InChI=1SC15H21NO5Sc1321147613(911(14)2)22(1920)1684512(1016)15(17)18h67912H35810H212H3(H1718)
BBL003275
Synonyms: ethyl2-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C/1\C(=O)c2c(C1=O)cccc2
CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=C1C(=O)c2c(C1=O)cccc2
ethyl2(3((13dioxo13dihydro2Hinden2ylidene)methyl)25dimethyl1Hpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
353508664
ZINC02185143
ZINC2185143
ethyl2(3((13dioxoinden2ylidene)methyl)25dimethylpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
CCOC(=O)C1=C(SC2=C1CCCC2)N3C(=CC(=C3C)C=C4C(=O)C5=CC=CC=C5C4=O)C
InChI=1SC27H25NO4Sc143227(31)232011781222(20)3326(23)2815(2)1317(16(28)3)142124(29)189561019(18)25(21)30h569101314H4781112H213H3
BBL003276
Synonyms: 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoicacid
Smiles: O=C1N(c2cccc(c2)C(=O)O)C(=O)C2C1C1C=CC2C2C1C2
O=C1N(c2cccc(c2)C(=O)O)C(=O)C2C1C1C=CC2C2C1C2
3((3AR4S4AS5AR6R6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)BENZOICACID
3(13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)BENZOICACID
354812581
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C5=CC=CC(=C5)C(=O)O
InChI=1SC18H15NO4c201614104511(13712(10)13)15(14)17(21)19(16)93128(69)18(22)23h161015H7H2(H2223)
BBL003277
Synonyms: 4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
OC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
354812649
4(13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)BENZOICACID
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C5=CC=C(C=C5)C(=O)O
InChI=1SC18H15NO4c201614105611(13712(10)13)15(14)17(21)19(16)9318(249)18(22)23h161015H7H2(H2223)
BBL003278
Synonyms: 5-(3-{(E)-[(4-bromophenyl)imino]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzene-1,3-dicarboxylicacid
Smiles: Brc1ccc(cc1)/N=C/c1cc(n(c1C)c1cc(cc(c1)C(=O)O)C(=O)O)C
Brc1ccc(cc1)N=Cc1cc(n(c1C)c1cc(cc(c1)C(=O)O)C(=O)O)C
5(3((E)((4bromophenyl)imino)methyl)25dimethyl1Hpyrrol1yl)benzene13dicarboxylicacid
593272572
BBL003279
Synonyms: 4-({(E)-[1-(2-ethyl-6-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}amino)phenol
Smiles: CCc1cccc(c1n1c(C)cc(c1C)/C=N/c1ccc(cc1)O)C
CCc1cccc(c1n1c(C)cc(c1C)C=Nc1ccc(cc1)O)C
4(((E)(1(2ethyl6methylphenyl)25dimethyl1Hpyrrol3yl)methylidene)amino)phenol
593272709
BBL003280
Synonyms: ethyl6-chloro-2-(4-methoxyphenyl)quinoline-4-carboxylate
Smiles: CCOC(=O)c1cc(nc2c1cc(Cl)cc2)c1ccc(cc1)OC
CCOC(=O)c1cc(nc2c1cc(Cl)cc2)c1ccc(cc1)OC
ETHYL6CHLORO2(4METHOXYPHENYL)4QUINOLINECARBOXYLATE
ETHYL6CHLORO2(4METHOXYPHENYL)QUINOLINE4CARBOXYLATE
355432994
ZINC00071146
ZINC71146
CCOC(=O)C1=CC(=NC2=C1C=C(C=C2)Cl)C3=CC=C(C=C3)OC
InChI=1SC19H16ClNO3c132419(22)161118(124714(232)8512)21179613(20)1015(16)17h411H3H212H3
BBL003281
Synonyms: 4-(2-{(E)-[1-(2-ethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-pyrrol-1-yl)benzoicacid
Smiles: CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cccn2c2ccc(cc2)C(=O)O)/C1=O
CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2c2ccc(cc2)C(=O)O)C1=O
675859015
ZINC4092117
4(2((1(2ETHYLPHENYL)246TRIOXO13DIHYDROPYRIMIDIN5YLIDENE)METHYL)PYRROLYL)BENZOICACID
4(2((E)(1(2ETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PYRROL1YL)BENZOICACID
4(2((E)(1(2ETHYLPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
CCC1=CC=CC=C1N2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)C(=O)O)C(=O)NC2=O
InChI=1SC24H19N3O5c1215634820(15)2722(29)19(21(28)2524(27)32)1418751326(18)1711916(101217)23(30)31h314H2H21H3(H3031)(H252832)b1914+
BBL003282
Synonyms: 3-({4-[(E)-2-cyano-2-phenylethenyl]phenoxy}methyl)benzoicacid
Smiles: N#C/C(=C/c1ccc(cc1)OCc1cccc(c1)C(=O)O)/c1ccccc1
N#CC(=Cc1ccc(cc1)OCc1cccc(c1)C(=O)O)c1ccccc1
ZINC12631201
3((4((E)2CYANO2PHENYLETHENYL)PHENOXY)METHYL)BENZOICACID
363567855
C1=CC=C(C=C1)C(=CC2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O)C#N
InChI=1SC23H17NO3c241521(196213719)131791122(121017)27161854820(1418)23(25)26h114H16H2(H2526)b2113
BBL003283
Synonyms: 2-{[(4-bromo-2-methylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: Brc1ccc(c(c1)C)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
Brc1ccc(c(c1)C)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
1005100742
2(((4BROMO2METHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=C(C=CC(=C1)Br)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC19H19BrN2O2c19610(20)2515(9)2182218(23)16113412(14713(11)14)17(16)19(22)24h261114161721H78H21H3
BBL003284
Synonyms: 2-{[(3,4-dimethylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: O=C1N(CNc2ccc(c(c2)C)C)C(=O)C2C1C1C=CC2C2C1C2
O=C1N(CNc2ccc(c(c2)C)C)C(=O)C2C1C1C=CC2C2C1C2
1005117667
2(((34DIMETHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=C(C=C(C=C1)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5)C
InChI=1SC20H22N2O2c1103412(711(10)2)2192219(23)17135614(16815(13)16)18(17)20(22)24h37131821H89H212H3
BBL003285
Synonyms: 2-{[(3-chloro-2-methylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: O=C1C2C3C=CC(C2C(=O)N1CNc1cccc(c1C)Cl)C1C3C1
O=C1C2C3C=CC(C2C(=O)N1CNc1cccc(c1C)Cl)C1C3C1
1005106397
2(((3CHLORO2METHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=C(C=CC=C1Cl)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC19H19ClN2O2c1914(20)32415(9)2182218(23)16105611(13712(10)13)17(16)19(22)24h261013161721H78H21H3
BBL003286
Synonyms: 2-{[(3-methylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: Cc1cccc(c1)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
Cc1cccc(c1)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
MFCD03274160
1005095157
2(((3METHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
2(((3METHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(3AH)DIONE
CC1=CC(=CC=C1)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC19H20N2O2c11032411(710)2092118(22)16125613(15814(12)15)17(16)19(21)23h27121720H89H21H3
BBL003287
Synonyms: 2-{[(4-bromophenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: O=C1C2C3C=CC(C2C(=O)N1CNc1ccc(cc1)Br)C1C3C1
O=C1C2C3C=CC(C2C(=O)N1CNc1ccc(cc1)Br)C1C3C1
1005099422
2(((4BROMOPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CNC5=CC=C(C=C5)Br
InChI=1SC18H17BrN2O2c1991310(429)2082117(22)15115612(14713(11)14)16(15)18(21)23h16111620H78H2
BBL003288
Synonyms: 2-{[(3-chlorophenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: Clc1cccc(c1)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
Clc1cccc(c1)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
1005052550
2(((3CHLOROPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CNC5=CC(=CC=C5)Cl
InChI=1SC18H17ClN2O2c19921310(69)2082117(22)15114512(14713(11)14)16(15)18(21)23h16111620H78H2
BBL003289
Synonyms: 2-{[(3-chloro-4-methylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: O=C1N(CNc2ccc(c(c2)Cl)C)C(=O)C2C1C1C=CC2C2C1C2
O=C1N(CNc2ccc(c(c2)Cl)C)C(=O)C2C1C1C=CC2C2C1C2
1005035233
2(((3CHLORO4METHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=C(C=C(C=C1)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5)Cl
InChI=1SC19H19ClN2O2c192310(615(9)20)2182218(23)16114512(14713(11)14)17(16)19(22)24h261114161721H78H21H3
BBL003290
Synonyms: 2-{[(2,4-dimethylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: Cc1ccc(c(c1)C)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
Cc1ccc(c(c1)C)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
1005160951
2(((24DIMETHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=CC(=C(C=C1)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5)C
InChI=1SC20H22N2O2c1103616(11(2)710)2192219(23)17124513(15814(12)15)18(17)20(22)24h371215171821H89H212H3
BBL003291
Synonyms: 2-{[(2,6-dimethylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: O=C1C2C3C=CC(C2C(=O)N1CNc1c(C)cccc1C)C1C3C1
O=C1C2C3C=CC(C2C(=O)N1CNc1c(C)cccc1C)C1C3C1
1005270007
2(((26DIMETHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=C(C(=CC=C1)C)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC20H22N2O2c11043511(2)18(10)2192219(23)16126713(15814(12)15)17(16)20(22)24h37121721H89H212H3
BBL003292
Synonyms: 2-{[(4-ethylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: CCc1ccc(cc1)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
CCc1ccc(cc1)NCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
1005106615
2(((4ETHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CCC1=CC=C(C=C1)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC20H22N2O2c12113512(6411)21102219(23)17137814(16915(13)16)18(17)20(22)24h38131821H2910H21H3
BBL003293
Synonyms: 2-{[(4-bromo-3,5-dimethylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Smiles: O=C1C2C3C=CC(C2C(=O)N1CNc1cc(C)c(c(c1)C)Br)C1C3C1
O=C1C2C3C=CC(C2C(=O)N1CNc1cc(C)c(c(c1)C)Br)C1C3C1
1005035222
2(((4BROMO35DIMETHYLPHENYL)AMINO)METHYL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CC1=CC(=CC(=C1Br)C)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC20H21BrN2O2c19511(610(2)18(9)21)2282319(24)16123413(15714(12)15)17(16)20(23)25h36121722H78H212H3
BBL003294
Synonyms: 6-methyl-2-[4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl]quinoline-4-carboxylicacid
Smiles: CC1CCC2C(C1)C(=O)N(C2=O)c1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)O)C
CC1CCC2C(C1)C(=O)N(C2=O)c1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)O)C
1005188555
6METHYL2(4(5METHYL13DIOXOOCTAHYDRO2HISOINDOL2YL)PHENYL)QUINOLINE4CARBOXYLICACID
6methyl2(4(5methyl13dioxo3a45677ahexahydroisoindol2yl)phenyl)quinoline4carboxylicacid
CC1CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=C(C=C(C=C5)C)C(=C4)C(=O)O
InChI=1SC26H24N2O4c114391820(1214)25(30)28(24(18)29)177516(6817)231321(26(31)32)191115(2)41022(19)2723h48101113141820H3912H212H3(H3132)
BBL003295
Synonyms: 8-chloro-2-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl]quinoline-4-carboxylicacid
Smiles: O=C1N(c2ccc(cc2)c2cc(C(=O)O)c3c(n2)c(Cl)ccc3)C(=O)C2C1CC=CC2
O=C1N(c2ccc(cc2)c2cc(C(=O)O)c3c(n2)c(Cl)ccc3)C(=O)C2C1CC=CC2
2(4(13DIOXO(473A7ATETRAHYDROISOINDOL2YL))PHENYL)8CHLOROQUINOLINE4CARBOXYLICACID
8CHLORO2(4(13DIOXO133A477AHEXAHYDRO2HISOINDOL2YL)PHENYL)QUINOLINE4CARBOXYLICACID
8CHLORO2(4(13DIOXO3A477ATETRAHYDROISOINDOL2YL)PHENYL)QUINOLINE4CARBOXYLICACID
669741086
C1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=C(C=CC=C5Cl)C(=C4)C(=O)O
InChI=1SC24H17ClN2O4c25197361518(24(30)31)1220(2621(15)19)1381014(11913)2722(28)16412517(16)23(27)29h136121617H45H2(H3031)
BBL003296
Synonyms: 2-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl]-6-methylquinoline-4-carboxylicacid
Smiles: Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)N1C(=O)C2C(C1=O)CC=CC2)C(=O)O
Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)N1C(=O)C2C(C1=O)CC=CC2)C(=O)O
2(4(13DIOXO(473A7ATETRAHYDROISOINDOL2YL))PHENYL)6METHYLQUINOLINE4CARBOXYLICACID
2(4(13DIOXO133A477AHEXAHYDRO2HISOINDOL2YL)PHENYL)6METHYLQUINOLINE4CARBOXYLICACID
2(4(13DIOXO3A477ATETRAHYDROISOINDOL2YL)PHENYL)6METHYLQUINOLINE4CARBOXYLICACID
669742090
CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(C=C3)N4C(=O)C5CC=CCC5C4=O
InChI=1SC25H20N2O4c1146112119(1214)20(25(30)31)1322(2621)157916(10815)2723(28)17423518(17)24(27)29h236131718H45H21H3(H3031)
BBL003297
Synonyms: methyl3-amino-5-nitrobenzoate
Smiles: COC(=O)c1cc(N)cc(c1)[N+](=O)[O-]
COC(=O)c1cc(N)cc(c1)(N+)(=O)(O)
23218931
3(METHOXYCARBONYL)5NITROANILINE
3AMINO5(METHOXYCARBONYL)NITROBENZENE
3AMINO5NITROBENZOICACIDMETHYLESTER
BENZOICACID3AMINO5NITROMETHYLESTER
METHYL3AMINO5NITROBENZOATE
METHYL5AMINO3NITROBENZOATE
ZINC00248689
ZINC248689
COC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))N
InChI=1SC8H8N2O4c1148(11)526(9)47(35)10(12)13h24H9H21H3
BBL003298
Synonyms: N-[3-(phenylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Smiles: O=C(c1ccccc1)Nc1sc2c(c1C(=O)c1ccccc1)CCCC2
O=C(c1ccccc1)Nc1sc2c(c1C(=O)c1ccccc1)CCCC2
N(3(phenylcarbonyl)4567tetrahydro1benzothiophen2yl)benzamide
67718596
ZINC000003142506
ZINC03142506
ZINC3142506
MFCD00550069
N(3benzoyl4567tetrahydro1benzothiophen2yl)benzamide
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4
InChI=1SC22H19NO2Sc2420(1593141015)191713781418(17)2622(19)2321(25)16115261216h16912H781314H2(H2325)
BBL003299
Synonyms: ethyl2-{[(4-chlorophenyl)carbonyl]amino}-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)c1ccc(cc1)Cl
CCOC(=O)c1c(scc1c1ccccc1)NC(=O)c1ccc(cc1)Cl
ETHYL2(((4CHLOROPHENYL)CARBONYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROBENZENE)AMIDO)4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROBENZOYL)AMINO)4PHENYL3THIOPHENECARBOXYLATE
ETHYL2((4CHLOROBENZOYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2(4CHLOROBENZAMIDO)4PHENYLTHIOPHENE3CARBOXYLATE
2(4CHLOROBENZOYLAMINO)4PHENYLTHIOPHENE3CARBOXYLICACIDETHYLESTER
3THIOPHENECARBOXYLICACID2((4CHLOROBENZOYL)AMINO)4PHENYLETHYLESTER
77261202
MFCD00266089
ZINC000001986257
ZINC01986257
ZINC1986257
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H16ClNO3Sc122520(24)1716(136435713)122619(17)2218(23)1481015(21)11914h312H2H21H3(H2223)
BBL003300
Synonyms: isoquinoline-1-thiol
Smiles: Sc1nccc2c1cccc2
Sc1nccc2c1cccc2
ZINC01648613
ZINC1648613
1ISOQUINOLINETHIOL
ISOQUINOLINE1(2H)THIONE
ISOQUINOLINE1THIOL
ISOQUINOLINETHIOL
2HISOQUINOLINE1THIONE
4702254
C1=CC=C2C(=C1)C=CNC2=S
InChI=1SC9H7NSc119842137(8)56109h16H(H1011)
BBL003301
Synonyms: 1-(4-nitrophenyl)-3-phenyl-1H-pyrazol-5-amine
Smiles: [O-][N+](=O)c1ccc(cc1)n1nc(cc1N)c1ccccc1
(O)(N+)(=O)c1ccc(cc1)n1nc(cc1N)c1ccccc1
1(4NITROPHENYL)3PHENYL1HPYRAZOL5AMINE
1(4NITROPHENYL)3PHENYL1HPYRAZOLE5AMINE
1HPYRAZOL5AMINE1(4NITROPHENYL)3PHENYL
2(4NITROPHENYL)5PHENYLPYRAZOL3AMINE
77746533
ZINC00451451
ZINC451451
C1=CC=C(C=C1)C2=NN(C(=C2)N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H12N4O2c16151014(114213511)1718(15)126813(9712)19(20)21h110H16H2
BBL003302
Synonyms: 4-[(4-chlorobenzyl)oxy]benzohydrazide
Smiles: NNC(=O)c1ccc(cc1)OCc1ccc(cc1)Cl
NNC(=O)c1ccc(cc1)OCc1ccc(cc1)Cl
ZINC00273206
ZINC273206
4((4CHLOROBENZYL)OXY)BENZOHYDRAZIDE
4((4CHLOROPHENYL)METHOXY)BENZOHYDRAZIDE
1(4(4CHLOROBENZYLOXY)BENZOYL)HYDRAZINE
136563592
C1=CC(=CC=C1COC2=CC=C(C=C2)C(=O)NN)Cl
InChI=1SC14H13ClN2O2c15125110(2612)919137311(4813)14(18)1716h18H916H2(H1718)
BBL003303
Synonyms: 2-amino-N-[2-(4-tert-butylphenoxy)ethyl]benzamide
Smiles: O=C(c1ccccc1N)NCCOc1ccc(cc1)C(C)(C)C
O=C(c1ccccc1N)NCCOc1ccc(cc1)C(C)(C)C
ZINC02876175
ZINC2876175
(2AMINOPHENYL)N(2(4(TERTBUTYL)PHENOXY)ETHYL)CARBOXAMIDE
2AMINON(2(4TERTBUTYLPHENOXY)ETHYL)BENZAMIDE
695207842
CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)C2=CC=CC=C2N
InChI=1SC19H24N2O2c119(23)1481015(11914)2313122118(22)16645717(16)20h411H121320H213H3(H2122)
BBL003304
Synonyms: 4-methoxy-2,3,5-trimethylbenzaldehyde
Smiles: O=Cc1cc(C)c(c(c1C)C)OC
O=Cc1cc(C)c(c(c1C)C)OC
ZINC03847643
ZINC3847643
4METHOXY235TRIMETHYLBENZALDEHYDE
59453564
CC1=C(C(=C(C(=C1)C=O)C)C)OC
InChI=1SC11H14O2c17510(612)8(2)9(3)11(7)134h56H14H3
BBL003305
Synonyms: 5-methylpyridine-3-carbonitrile
Smiles: Cc1cc(cnc1)C#N
Cc1cc(cnc1)C#N
ZINC08294945
ZINC8294945
3CYANO5METHYLPYRIDINE
3CYANO5METHYLPYRIDINE(3CYANO5PICOLINE)
3PYRIDINECARBONITRILE5METHYL
42885143
5CYANO3METHYLPYRIDINE
5CYANO3PICOLINE
5METHYL3PYRIDINECARBONITRILE
5METHYLNICOTINONITRILE
5METHYLPYRIDINE3CARBONITRILE
CC1=CN=CC(=C1)C#N
InChI=1SC7H6N2c1627(38)5946h245H1H3
BBL003306
Synonyms: heptan-4-amine
Smiles: CCCC(CCC)N
CCCC(CCC)N
HEPT4YLAMINE
HEPTAN4AMINE
MFCD00014814
ZINC000002006936
ZINC2006936
(1PROPYLBUTYL)AMINEHYDROCHLORIDE
16751590
1PROPYLBUTANAMINE
1PROPYLBUTYLAMINE
4AMINOHEPTANE
4HEPTANAMINE
4HEPTYLAMINE
BUTYLAMINE1PROPYL
InChI=1SC7H17Nc1357(8)642h7H368H212H3
BBL003307
Synonyms: (2E)-1-(4-chlorophenyl)-3-(4-ethoxy-3-methoxyphenyl)prop-2-en-1-one
Smiles: CCOc1ccc(cc1OC)/C=C/C(=O)c1ccc(cc1)Cl
CCOc1ccc(cc1OC)C=CC(=O)c1ccc(cc1)Cl
ZINC05908073
ZINC5908073
(2E)1(4CHLOROPHENYL)3(4ETHOXY3METHOXYPHENYL)PROP2EN1ONE
(E)1(4CHLOROPHENYL)3(4ETHOXY3METHOXYPHENYL)PROP2EN1ONE
649573046
CCOC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl)OC
InChI=1SC18H17ClO3c13221711513(1218(17)212)41016(20)146815(19)9714h412H3H212H3b104+
BBL003308
Synonyms: (2E)-1-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1ccc(cc1)C
COc1cc(ccc1OC)C(=O)C=Cc1ccc(cc1)C
ZINC04954154
ZINC4954154
34DIMETHOXY4METHYLCHALCONE
(2E)1(34DIMETHOXYPHENYL)3(4METHYLPHENYL)PROP2EN1ONE
(E)1(34DIMETHOXYPHENYL)3(4METHYLPHENYL)PROP2EN1ONE
214264387
CC1=CC=C(C=C1)C=CC(=O)C2=CC(=C(C=C2)OC)OC
InChI=1SC18H18O3c1134614(7513)81016(19)1591117(202)18(1215)213h412H13H3b108+
BBL003309
Synonyms: 2,5-dihydro-3H-[1,2,4]triazino[5,6-b]indole-3-thione
Smiles: S=c1[nH]nc2c(n1)[nH]c1c2cccc1
S=c1(nH)nc2c(n1)(nH)c1c2cccc1
25dihydro3H(124)triazino(56b)indole3thione
28668953
BBL003310
Synonyms: 3,6,6-trimethyl-1-(2-methylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
Smiles: O=C1CC(C)(C)Cc2c1c(C)nn2c1ccccc1C
O=C1CC(C)(C)Cc2c1c(C)nn2c1ccccc1C
366trimethyl1(2methylphenyl)1567tetrahydro4Hindazol4one
366TRIMETHYL1(2METHYLPHENYL)1H567TRIHYDROINDAZOL4ONE
366TRIMETHYL1(2METHYLPHENYL)57DIHYDROINDAZOL4ONE
442643109
ZINC000000140641
ZINC00140641
ZINC140641
MFCD03036610
CC1=CC=CC=C1N2C3=C(C(=N2)C)C(=O)CC(C3)(C)C
InChI=1SC17H20N2Oc111756813(11)1914917(34)1015(20)16(14)12(2)1819h58H910H214H3
BBL003311
Synonyms: [(5Z)-5-(2,4-dichlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2ccc(cc2Cl)Cl)/C1=O
OC(=O)CN1C(=S)SC(=Cc2ccc(cc2Cl)Cl)C1=O
ZINC000000966921
ZINC966921
2(5((24DICHLOROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
((5Z)5(24DICHLOROBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
(5(24DICHLOROBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
(5(24DICHLOROBENZYLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)ACETICACID
1527479577
2((5Z)5((24DICHLOROPHENYL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)ACETICACID
MFCD00564619
2((5Z)5((24dichlorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
C1=CC(=C(C=C1Cl)Cl)C=C2C(=O)N(C(=S)S2)CC(=O)O
InChI=1SC12H7Cl2NO3S2c137216(8(14)47)3911(18)15(510(16)17)12(19)209h14H5H2(H1617)b93
BBL003312
Synonyms: 3-hydroxy-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccc(cc1)C(=O)CC1(O)C(=O)Nc2c1cccc2
COc1ccc(cc1)C(=O)CC1(O)C(=O)Nc2c1cccc2
3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)13DIHYDRO2HINDOL2ONE
3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)13DIHYDROINDOL2ONE
3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)1HINDOL2ONE
3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)INDOLIN2ONE
70452265
COC1=CC=C(C=C1)C(=O)CC2(C3=CC=CC=C3NC2=O)O
InChI=1SC17H15NO4c122128611(7912)15(19)1017(21)13423514(13)1816(17)20h2921H10H21H3(H1820)
BBL003313
Synonyms: 5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=c1[nH]cnc2c1c(cs2)c1ccccc1
O=c1(nH)cnc2c1c(cs2)c1ccccc1
THIENO(23D)PYRIMIDIN4(1H)ONE5PHENYL
ZINC18149209
ZINC8578704
35978393
4HYDROXY5PHENYLTHIENO(23D)PYRIMIDINE
5PHENYL3HTHIENO(23D)PYRIMIDIN4ONE
5PHENYL3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE
5PHENYLTHIENO(23D)PYRIMIDIN4(1H)ONE
5PHENYLTHIENO(23D)PYRIMIDIN4(3H)ONE
5PHENYLTHIENO(23D)PYRIMIDIN4OL
5PHENYLTHIENO(23D)PYRIMIDIN4ONE
C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC=N3
InChI=1SC12H8N2OSc1511109(8421358)61612(10)1471311h17H(H131415)
BBL003314
Synonyms: 4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1C1CCCCC1)c1cccnc1
Sc1nnc(n1C1CCCCC1)c1cccnc1
ZINC000018179771
ZINC18179771
4CYCLOHEXYL3(3PYRIDYL)124TRIAZOLINE5THIONE
4CYCLOHEXYL3PYRIDIN3YL1H124TRIAZOLE5THIONE
4CYCLOHEXYL5(3PYRIDINYL)24DIHYDRO3H124TRIAZOLE3THIONE
4CYCLOHEXYL5(PYRIDIN3YL)24DIHYDRO3H124TRIAZOLE3THIONE
4CYCLOHEXYL5(PYRIDIN3YL)4H124TRIAZOLE3THIOL
4CYCLOHEXYL5PYRIDIN3YL4H(124)TRIAZOLE3THIOL
26028999
MFCD03030045
C1CCC(CC1)N2C(=NNC2=S)C3=CN=CC=C3
InChI=1SC13H16N4Sc1813161512(1054814910)17(13)116213711h458911H1367H2(H1618)
BBL003315
Synonyms: ethyl5-(acetyloxy)-6-bromo-2-(bromomethyl)-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(CBr)n(c2c1cc(OC(=O)C)c(c2)Br)C
CCOC(=O)c1c(CBr)n(c2c1cc(OC(=O)C)c(c2)Br)C
ETHYL1METHYL2BROMOMETHYL5ACETOXY6BROMO1HINDOLE3CARBOXYLATE
ETHYL5(ACETYLOXY)6BROMO2(BROMOMETHYL)1METHYL1HINDOLE3CARBOXYLATE
ETHYL5ACETOXY6BROMO2(BROMOMETHYL)1METHYL1HINDOLE3CARBOXYLATE
ETHYL5ACETOXY6BROMO2(BROMOMETHYL)1METHYLINDOLE3
ETHYL5ACETOXY6BROMO2(BROMOMETHYL)1METHYLINDOLE3CARBOXYLATE
ETHYL5ACETYLOXY6BROMO2(BROMOMETHYL)1METHYLINDOLE3CARBOXYLATE
110543981
1HINDOLE3CARBOXYLICACID5(ACETYLOXY)6BROMO2(BROMOMETHYL)1METHYLETHYLESTER
5ACETOXY6BROMO2BROMOMETHYL1METHYL1HINDOLE3CARBOXYLICACIDETHYLESTER
BROMINDOLE
MFCD00407019
ZINC000000847306
ZINC00847306
ZINC847306
6BROMO2(BROMOMETHYL)3(ETHOXYCARBONYL)1METHYLINDOL5YLACETATE
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CBr
InChI=1SC15H15Br2NO4c142115(20)149513(228(2)19)10(17)611(9)18(3)12(14)716h56H47H213H3
BBL003316
Synonyms: 3-{[(4,5-dimethylfuran-2-yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1oc(c(c1)C)C)Nc1cccc(c1)C(=O)O
O=C(c1oc(c(c1)C)C)Nc1cccc(c1)C(=O)O
ZINC275124
3(((45DIMETHYL2FURANYL)OXOMETHYL)AMINO)BENZOICACID
3(((45DIMETHYLFURAN2YL)CARBONYL)AMINO)BENZOICACID
3((45DIMETHYL2FUROYL)AMINO)BENZOICACID
3((45DIMETHYL2FURYL)CARBONYLAMINO)BENZOICACID
3((45DIMETHYLFURAN2CARBONYL)AMINO)BENZOICACID
3((45DIMETHYLFURAN2YL)CARBONYLAMINO)BENZOICACID
332129632
CC1=C(OC(=C1)C(=O)NC2=CC=CC(=C2)C(=O)O)C
InChI=1SC14H13NO4c18612(199(8)2)13(16)151153410(711)14(17)18h37H12H3(H1516)(H1718)
BBL003317
Synonyms: diethyl5-amino-1H-pyrazole-1,4-dicarboxylate
Smiles: CCOC(=O)c1cnn(c1N)C(=O)OCC
CCOC(=O)c1cnn(c1N)C(=O)OCC
DIETHYL5AMINO1HPYRAZOLE14DICARBOXYLATE
DIETHYL5AMINOPYRAZOLE14DICARBOXYLATE
ETHYL5AMINO4(ETHOXYCARBONYL)PYRAZOLECARBOXYLATE
MFCD02039624
PYRAZOLE14DICARBOXYLICACID5AMINODIETHYLESTER
ZINC000000127735
ZINC00127735
ZINC127735
5AMINO14DIETHOXYCARBONYLPYRAZOLE
220131602
5AMINOPYRAZOLE14DICARBOXYLICACIDDIETHYLESTER
CCOC(=O)C1=C(N(N=C1)C(=O)OCC)N
InChI=1SC9H13N3O4c13158(13)651112(7(6)10)9(14)1642h5H3410H212H3
BBL003318
Synonyms: 5,6-dimethyl-2-phenyl-4H-thieno[2,3-d][1,3]oxazin-4-one
Smiles: O=c1oc(nc2c1c(C)c(s2)C)c1ccccc1
O=c1oc(nc2c1c(C)c(s2)C)c1ccccc1
ZINC000000053353
ZINC00053353
ZINC53353
56DIMETHYL2PHENYL4HTHIENO(23D)(13)OXAZIN4ONE
56DIMETHYL2PHENYLTHIENO(23D)(13)OXAZIN4ONE
56DIMETHYL2PHENYLTHIOPHENO(23D)13OXAZIN4ONE
63274602
MFCD00450863
CC1=C(SC2=C1C(=O)OC(=N2)C3=CC=CC=C3)C
InChI=1SC14H11NO2Sc189(2)181311(8)14(16)1712(1513)106435710h37H12H3
BBL003319
Synonyms: 3-acetyl-1-(4-methoxyphenyl)-2-methyl-1H-indol-5-ylacetate
Smiles: COc1ccc(cc1)n1c2ccc(cc2c(c1C)C(=O)C)OC(=O)C
COc1ccc(cc1)n1c2ccc(cc2c(c1C)C(=O)C)OC(=O)C
(3ACETYL1(4METHOXYPHENYL)2METHYLINDOL5YL)ACETATE
119953116
3ACETYL1(4METHOXYPHENYL)2METHYL1HINDOL5YLACETATE
3ACETYL1(4METHOXYPHENYL)2METHYLINDOL5YLACETATE
ACETICACID3ACETYL1(4METHOXYPHENYL)2METHYL1HINDOL5YLESTER
MFCD00770216
ZINC000000102304
ZINC00102304
ZINC102304
CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)C)C(=O)C
InChI=1SC20H19NO4c11220(13(2)22)181117(2514(3)23)91019(18)21(12)155716(244)8615h511H14H3
BBL003320
Synonyms: acridin-4-amine
Smiles: Nc1cccc2c1nc1ccccc1c2
Nc1cccc2c1nc1ccccc1c2
ZINC000004773449
ZINC04773449
ZINC4773449
MFCD01960886
1AMINOACRIDINE(EUROPEAN)
4ACRIDINAMINE
4ACRIDINAMINE(9CI)
4AMINOACRIDINE
4AMINOAKRIDIN
578074
5AMINOACRIDINE
ACRIDIN4AMINE
ACRIDIN4AMINEHYDROCHLORIDE
ACRIDIN4YLAMINE
ACRIDINE4AMINO
ACRIDINE4YLAMINE
C1=CC=C2C(=C1)C=C3C=CC=C(C3=N2)N
InChI=1SC13H10N2c14116351089412712(9)1513(10)11h18H14H2
BBL003321
Synonyms: 4-{[(3-chlorophenyl)(methylsulfonyl)amino]methyl}benzoicacid
Smiles: Clc1cccc(c1)N(S(=O)(=O)C)Cc1ccc(cc1)C(=O)O
Clc1cccc(c1)N(S(=O)(=O)C)Cc1ccc(cc1)C(=O)O
MFCD01964860
ZINC000004641509
ZINC4641509
359409851
4(((3CHLOROPHENYL)(METHYLSULFONYL)AMINO)METHYL)BENZOICACID
4(((3CHLOROPHENYL)METHANESULFONYLAMINO)METHYL)BENZOICACID
4((3CHLORONMETHYLSULFONYLANILINO)METHYL)BENZOICACID
CHLOROPHENYL)METHANESULFONAMIDO)METHYL)BENZOICACID
CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)O)C2=CC(=CC=C2)Cl
InChI=1SC15H14ClNO4Sc122(2021)17(1442313(16)914)10115712(8611)15(18)19h29H10H21H3(H1819)
BBL003322
Synonyms: 2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Smiles: COc1cc(CCNC(=O)c2ccccc2N)ccc1OC
COc1cc(CCNC(=O)c2ccccc2N)ccc1OC
(2AMINOPHENYL)N(2(34DIMETHOXYPHENYL)ETHYL)CARBOXAMIDE
125232066
2AMINON(2(34DIMETHOXYPHENYL)ETHYL)BENZAMIDE
MFCD00115978
ZINC000000150127
ZINC00150127
ZINC150127
BENZAMIDE2AMINON(2(34DIMETHOXYPHENYL)ETHYL)
COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2N)OC
InChI=1SC17H20N2O3c121158712(1116(15)222)9101917(20)13534614(13)18h3811H91018H212H3(H1920)
BBL003323
Synonyms: 1-(3-methylphenyl)-1H-benzimidazol-5-amine
Smiles: Nc1ccc2c(c1)ncn2c1cccc(c1)C
Nc1ccc2c(c1)ncn2c1cccc(c1)C
ZINC01431382
ZINC1431382
1(3METHYLPHENYL)13BENZODIAZOL5AMINE
1(3METHYLPHENYL)1HBENZIMIDAZOL5AMINE
1(3METHYLPHENYL)1HBENZIMIDAZOL5AMINEDIHYDROCHLORIDE
1(3METHYLPHENYL)1HBENZIMIDAZOL5YLAMINE
1(3METHYLPHENYL)BENZIMIDAZOL5AMINE
1(3METHYLPHENYL)BENZIMIDAZOLE5YLAMINE
1HBENZIMIDAZOL5AMINE1(3METHYLPHENYL)
1HBENZOIMIDAZOLE5AMINO1MTOLYL
1MTOLYL1HBENZOIMIDAZOL5YLAMINE
887407376
ARYLAMINECOMPOUND4
CC1=CC(=CC=C1)N2C=NC3=C2C=CC(=C3)N
InChI=1SC14H13N3c11032412(710)1791613811(15)5614(13)17h29H15H21H3
BBL003324
Synonyms: [(5Z)-5-(4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)O
COc1ccc(cc1)C=C1SC(=S)N(C1=O)CC(=O)O
2(5((4METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
((5Z)5(4METHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
(5(4METHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
1266675608
ZINC12574387
2((5Z)5((4methoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
COC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O
InChI=1SC13H11NO4S2c1189428(359)61012(17)14(711(15)16)13(19)2010h26H7H21H3(H1516)b106
BBL003325
Synonyms: 4-(furan-2-yl)-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: NC1=NC(n2c(N1)nc1c2cccc1)c1ccco1
NC1=NC(n2c(N1)nc1c2cccc1)c1ccco1
ZINC000004702787
ZINC000004702788
MFCD04196539
135TRIAZINO(12A)BENZIMIDAZOL2AMINE4(2FURANYL)14DIHYDRO
305851858
4(2FURYL)14DIHYDRO(135)TRIAZINO(12A)BENZIMIDAZOL2AMINE
4(2FURYL)1H4H135TRIAZINO(32A)BENZIMIDAZOLE2YLAMINE
4(FURAN2YL)14DIHYDRO(135)TRIAZINO(12A)BENZIMIDAZOL2AMINE
4(FURAN2YL)14DIHYDROBENZO(45)IMIDAZO(12A)(135)TRIAZIN2AMINE
4(FURAN2YL)34DIHYDRO(135)TRIAZINO(12A)BENZIMIDAZOL2AMINE
4(FURAN2YL)410DIHYDRO(135)TRIAZINO(12A)BENZIMIDAZOL2AMINE
C1=CC=C2C(=C1)NC3=NC(=NC(N23)C4=CC=CO4)N
InChI=1SC13H11N5Oc14121611(106371910)18952148(9)1513(18)1712h1711H(H314151617)
BBL003326
Synonyms: N''-[(E)-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}methylidene]carbonohydrazonicdiamide
Smiles: CCOc1cc(/C=N/N=C(N)N)ccc1OCc1ccc(cc1)Cl
CCOc1cc(C=NN=C(N)N)ccc1OCc1ccc(cc1)Cl
N((E)(4((4CHLOROBENZYL)OXY)3ETHOXYPHENYL)METHYLIDENE)CARBONOHYDRAZONICDIAMIDE
N(4((4CHLOROBENZYL)OXY)3ETHOXYBENZYLIDENE)CARBONOHYDRAZONICDIAMIDE
ZINC6507669
2((4((4CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)METHYLIDENEAMINO)GUANIDINE
2((4(4CHLOROBENZYL)OXY3ETHOXYBENZYLIDENE)AMINO)GUANIDINE
340221956
2((E)(4((4chlorophenyl)methoxy)3ethoxyphenyl)methylideneamino)guanidine
CCOC1=C(C=CC(=C1)C=NN=C(N)N)OCC2=CC=C(C=C2)Cl
InChI=1SC17H19ClN4O2c122316913(10212217(19)20)5815(16)2411123614(18)7412h310H211H21H3(H4192022)b2110+
BBL003327
Synonyms: 7-(4-chlorophenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Smiles: Clc1ccc(cc1)c1cc(C)nc2n1nc(n2)N
Clc1ccc(cc1)c1cc(C)nc2n1nc(n2)N
ZINC00615752
ZINC615752
(7(4CHLOROPHENYL)5METHYL(124)TRIAZOLO(15A)PYRIMIDIN2YL)AMINE
7(4CHLOROPHENYL)5METHYL(124)TRIAZOLO(15
7(4CHLOROPHENYL)5METHYL(124)TRIAZOLO(15A)PYRIMIDIN2AMINE
7(4CHLOROPHENYL)5METHYL(124)TRIAZOLO(15A)PYRIMIDIN2YLAMINE
714278258
CC1=NC2=NC(=NN2C(=C1)C3=CC=C(C=C3)Cl)N
InChI=1SC12H10ClN5c17610(8249(13)538)1812(157)1611(14)1718h26H1H3(H21417)
BBL003328
Synonyms: [(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O
OC(=O)CN1C(=S)SC(=Cc2ccc(cc2)Cl)C1=O
ZINC966815
5(4CHLOROBENZYLIDENE)2THIOXO4OXOTHIAZOLIDINE3ACETICACID
((5Z)5(4CHLOROBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
1151944647
2((5Z)5((4CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((4CHLOROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)CC(=O)O)Cl
InChI=1SC12H8ClNO3S2c138317(248)5911(17)14(610(15)16)12(18)199h15H6H2(H1516)b95
BBL003329
Synonyms: [(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O
OC(=O)CN1C(=S)SC(=Cc2ccccc2Cl)C1=O
ZINC000000966940
ZINC966940
MFCD03834569
((5Z)5(2CHLOROBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
82158574
2((5Z)5((2chlorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)Cl
InChI=1SC12H8ClNO3S2c13842137(8)5911(17)14(610(15)16)12(18)199h15H6H2(H1516)b95
BBL003330
Synonyms: [4-(2-aminoethoxy)phenyl](phenyl)methanone
Smiles: NCCOc1ccc(cc1)C(=O)c1ccccc1
NCCOc1ccc(cc1)C(=O)c1ccccc1
ZINC5735453
(4(2AMINOETHOXY)PHENYL)(PHENYL)METHANONE
(4(2AMINOETHOXY)PHENYL)(PHENYL)METHANONEHYDROCHLORIDE
(4(2AMINOETHOXY)PHENYL)PHENYLMETHANONE
2(PBENZOYLPHENOXY)ETHYLAMINE
4(2AMINOETHOXY)PHENYLPHENYLKETONE
72489839
C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCCN
InChI=1SC15H15NO2c16101118148613(7914)15(17)124213512h19H101116H2
BBL003331
Synonyms: 2-(chloromethyl)-5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazole
Smiles: COc1cc(ccc1OC)c1nnc(o1)CCl
COc1cc(ccc1OC)c1nnc(o1)CCl
2(CHLOROMETHYL)5(34DIMETHOXYPHENYL)134OXADIAZOLE
4(5(CHLOROMETHYL)(134OXADIAZOL2YL))12DIMETHOXYBENZENE
696604747
MFCD05854526
ZINC000001425365
ZINC01425365
ZINC1425365
COC1=C(C=C(C=C1)C2=NN=C(O2)CCl)OC
InChI=1SC11H11ClN2O3c1158437(59(8)162)11141310(612)1711h35H6H212H3
BBL003332
Synonyms: 2-amino-N-[2-(4-methoxyphenoxy)ethyl]benzamide
Smiles: COc1ccc(cc1)OCCNC(=O)c1ccccc1N
COc1ccc(cc1)OCCNC(=O)c1ccccc1N
MFCD10021543
ZINC000020192907
ZINC20192907
(2AMINOPHENYL)N(2(4METHOXYPHENOXY)ETHYL)CARBOXAMIDE
1018277321
2AMINON(2(4METHOXYPHENOXY)ETHYL)BENZAMIDE
COC1=CC=C(C=C1)OCCNC(=O)C2=CC=CC=C2N
InChI=1SC16H18N2O3c120126813(9712)2111101816(19)14423515(14)17h29H101117H21H3(H1819)
BBL003333
Synonyms: 5-[(3-fluorophenyl)amino]-5-oxopentanoicacid
Smiles: O=C(Nc1cccc(c1)F)CCCC(=O)O
O=C(Nc1cccc(c1)F)CCCC(=O)O
ZINC000000281988
ZINC281988
MFCD00157523
198879764
4((3FLUOROPHENYL)CARBAMOYL)BUTANOICACID
4(N(3FLUOROPHENYL)CARBAMOYL)BUTANOICACID
5((3FLUOROPHENYL)AMINO)5OXOPENTANOICACID
5(3FLUOROANILINO)5OXOPENTANOICACID
C1=CC(=CC(=C1)F)NC(=O)CCCC(=O)O
InChI=1SC11H12FNO3c1283149(78)1310(14)52611(15)16h1347H256H2(H1314)(H1516)
BBL003334
Synonyms: 4-formylphenyl4-fluorobenzoate
Smiles: O=Cc1ccc(cc1)OC(=O)c1ccc(cc1)F
O=Cc1ccc(cc1)OC(=O)c1ccc(cc1)F
ZINC02550897
ZINC2550897
ZINC000002550897
(4FORMYLPHENYL)4FLUOROBENZOATE
4FORMYLPHENYL4FLUOROBENZOATE
84728949
MFCD00434610
C1=CC(=CC=C1C=O)OC(=O)C2=CC=C(C=C2)F
InChI=1SC14H9FO3c15125311(4612)14(17)18137110(916)2813h19H
BBL003335
Synonyms: (2E)-1-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)c2ccc(cc2)Cl)ccc1OC
COc1cc(C=CC(=O)c2ccc(cc2)Cl)ccc1OC
ZINC04252509
ZINC4252509
(2E)1(4CHLOROPHENYL)3(34DIMETHOXYPHENYL)PROP2EN1ONE
(2E)3(34DIMETHOXYPHENYL)1(4CHLOROPHENYL)PROP2EN1ONE
(E)1(4CHLOROPHENYL)3(34DIMETHOXYPHENYL)2PROPENE1ONE
(E)1(4CHLOROPHENYL)3(34DIMETHOXYPHENYL)PROP2EN1ONE
1(4CHLOROPHENYL)3(34DIMETHOXYPHENYL)2PROPENE1ONE
53744299
COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl)OC
InChI=1SC17H15ClO3c1201610412(1117(16)212)3915(19)135714(18)8613h311H12H3b93+
BBL003336
Synonyms: N'-(3-aminopropyl)-N,N-dimethylpropane-1,3-diamine
Smiles: NCCCNCCCN(C)C
NCCCNCCCN(C)C
NNDIMETHYLDIPROPYLENETRIAMINE
NNDIMETHYLDIPROPYLTRIAMINE
ZINC000002572127
ZINC2572127
(3((3AMINOPROPYL)AMINO)PROPYL)DIMETHYLAMINE
(3AMINOPROPYL)(3(DIMETHYLAMINO)PROPYL)AMINE
10563298
13PROPANEDIAMINEN(3AMINOPROPYL)NNDIMETHYL
13PROPANEDIAMINEN3(3AMINOPROPYL)N1N1DIMETHYL
DIMETHYLDIPROPYLENETRIAMINE
MFCD00082192
N(3(DIMETHYLAMINO)PROPYL)PROPANE13DIAMINE
N(3AMINOPROPYL)NNDIMETHYLPROPANE13DIAMINE
N(3DIMETHYLAMINOPROPYL)13PROPANEDIAMINE
N(GAMMADIMETHYLAMINOPROPYL)13DIAMINOPROPANE
CN(C)CCCNCCCN
InChI=1SC8H21N3c111(2)847106359h10H39H212H3
BBL003337
Synonyms: (2E)-1-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1ccc(cc1)F
COc1cc(ccc1OC)C(=O)C=Cc1ccc(cc1)F
ZINC04949649
ZINC4949649
(2E)1(34DIMETHOXYPHENYL)3(4FLUOROPHENYL)PROP2EN1ONE
(E)1(34DIMETHOXYPHENYL)3(4FLUOROPHENYL)PROP2EN1ONE
1056445125
COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)F)OC
InChI=1SC17H15FO3c1201610613(1117(16)212)15(19)95123714(18)8412h311H12H3b95+
BBL003338
Synonyms: 3-(4-tert-butylphenyl)propan-1-amine
Smiles: NCCCc1ccc(cc1)C(C)(C)C
NCCCc1ccc(cc1)C(C)(C)C
ZINC8382912
3(4(TERTBUTYL)PHENYL)PROPYLAMINE
3(4TERTBUTYLPHENYL)PROPAN1AMINE
3(4TERTBUTYLPHENYL)PROPYLAMINE
4(11DIMETHYLETHYL)BENZENEPROPANAMINE
800395533
BENZENEPROPANAMINE4(11DIMETHYLETHYL)
CC(C)(C)C1=CC=C(C=C1)CCCN
InChI=1SC13H21Nc113(23)128611(7912)541014h69H451014H213H3
BBL003339
Synonyms: 4-bromo-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: BrC1C(=NN(C1=O)c1ccccc1)C
BrC1C(=NN(C1=O)c1ccccc1)C
1PHENYL3METHYL4BROMO2PYRAZOLINE5ONE
3HPYRAZOL3ONE4BROMO24DIHYDRO5METHYL2PHENYL
4BROMO3METHYL1PHENYL2PYRAZOLIN5ONE
4BROMO5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
4BROMO5METHYL2PHENYL4HPYRAZOL3ONE
CC1=NN(C(=O)C1Br)C2=CC=CC=C2
InChI=1SC10H9BrN2Oc179(11)10(14)13(127)8532468h269H1H3
BBL003340
Synonyms: N-(4-chlorophenyl)imidodicarbonimidicdiamide
Smiles: N=C(Nc1ccc(cc1)Cl)NC(=N)N
N=C(Nc1ccc(cc1)Cl)NC(=N)N
ZINC000013467525
ZINC13467525
IMIDODICARBONIMIDICDIAMIDEN(4CHLOROPHENYL)
MFCD00045590
N(4CHLOROPHENYL)IMIDODICARBONIMIDICDIAMIDE
N(4CHLOROPHENYL)IMIDODICARBONIMIDICDIAMIDEHYDROCHLORIDE
(((4CHLOROANILINO)(IMINO)METHYL)AMINO)METHANIMIDAMIDE
1(4CHLOROPHENYL)BIGUANIDE
1CARBAMIMIDAMIDON(4CHLOROPHENYL)METHANIMIDAMIDE
1CARBAMIMIDOYL3(4CHLOROPHENYL)GUANIDINE
2(4CHLOROPHENYL)1(DIAMINOMETHYLIDENE)GUANIDINE
4CHLOROPHENYLBIGUANIDE
5304596
AMINO(((4CHLOROPHENYL)AMINO)IMINOMETHYL)CARBOXAMIDINE
BIGUANIDE1(PCHOROPHENYL)
C1=CC(=CC=C1N=C(N)N=C(N)N)Cl
InChI=1SC8H10ClN5c95136(425)138(12)147(10)11h14H(H61011121314)
BBL003341
Synonyms: 4-amino-5-(hydroxymethyl)pyrimidin-2-ol
Smiles: OCc1cnc(nc1N)O
OCc1cnc(nc1N)O
ZINC00399529
ZINC399529
1123951
2(1H)PYRIMIDINONE4AMINO5(HYDROXYMETHYL)
2(1H)PYRIMIDINONE4AMINO5(HYDROXYMETHYL)(9CI)
2(1H)PYRIMIDINONE6AMINO5(HYDROXYMETHYL)
4AMINO2HYDROXY5HYDROXYMETHYLPYRIMIDINE
4AMINO5(HYDROXYMETHYL)2(1H)PYRIMIDINONE
4AMINO5(HYDROXYMETHYL)PYRIMIDIN2(1H)ONE
4AMINO5(HYDROXYMETHYL)PYRIMIDIN2OL
4AMINO5HYDROXYMETHYL2(1H)PYRIMIDINONE
4AMINO5HYDROXYMETHYLPYRIMIDIN2OL
5HYDROXYMETHYLCYTOSINE
6AMINO5(HYDROXYMETHYL)12DIHYDROPYRIMIDIN2ONE
6AMINO5(HYDROXYMETHYL)1HPYRIMIDIN2ONE
C1=NC(=O)NC(=C1CO)N
InChI=1SC5H7N3O2c643(29)175(10)84h19H2H2(H367810)
BBL003342
Synonyms: 4,4,4-trifluoro-1-{4-[(4-fluorobenzyl)oxy]phenyl}butane-1,3-dione
Smiles: Fc1ccc(cc1)COc1ccc(cc1)C(=O)CC(=O)C(F)(F)F
Fc1ccc(cc1)COc1ccc(cc1)C(=O)CC(=O)C(F)(F)F
ZINC101033702
1017522789
444TRIFLUORO1(4((4FLUOROBENZYL)OXY)PHENYL)BUTANE13DIONE
444trifluoro1(4((4fluorophenyl)methoxy)phenyl)butane13dione
C1=CC(=CC=C1COC2=CC=C(C=C2)C(=O)CC(=O)C(F)(F)F)F
InChI=1SC17H12F4O3c18135111(2613)1024147312(4814)15(22)916(23)17(1920)21h18H910H2
BBL003343
Synonyms: 2-(diethylamino)ethyl4-amino-3-butoxybenzoate
Smiles: CCCCOc1cc(ccc1N)C(=O)OCCN(CC)CC
CCCCOc1cc(ccc1N)C(=O)OCCN(CC)CC
DIETHYLAMINOETHYL4AMINO3BUTOXYBENZOATE
DORSACAINE
DORSACAINEHYDROCHLORIDE
MFCD00242863
MINIMSOXYBUPROCAINEREG
MONOFREEOXYBUPROCAINE
2(4AMINO3BUTOXYBENZOYL)OXYETHYLDIETHYLAMMONIUMCHLORIDE
2(4AMINO3BUTOXYBENZOYL)OXYETHYLDIETHYLAZANIUMCHLORIDE
MONOFREEOXYBUPROCAINE(TN)
NOVESCINE
NOVESINOL
OXIBUPROCAINA
OXIBUPROCAINUM
OXIBUPROKAIN
OXYBUPROCAINE
OXYBUPROCAINE(INN)
OXYBUPROCAINE(INNBAN)
OXYBUPROCAINEHCL
OXYBUPROCAINEHYDROCHLORIDE
OXYBUPROCAINUM
OXYBUPROCAINUM(INNLATIN)
OXYRIPROCAINE
ZINC000002019492
ZINC2019492
2(DIETHYLAMINO)ETHYL4AMINO3BUTOXYBENZOATE
2(DIETHYLAMINO)ETHYL4AMINO3NBUTOXYBENZOATE
2DIETHYLAMINOETHYL4AMINO3BUTOXYBENZOATE
3BUTOXY4AMINOBENZOICACID2(DIETHYLAMINO)ETHYLESTER
3BUTOXY4AMINOBENZOICACID2DIETHYLAMINOETHYLESTER
4AMINO3BUTOXY2(DIETHYLAMINO)ETHYLESTERBENZOICACID
4AMINO3BUTOXYBENZOICACID2(DIETHYLAMINO)ETHYLESTER
4AMINO3BUTOXYBENZOICACID2DIETHYLAMINOETHYLESTER
4AMINO3NBUTOXYBENZOESAEUREDIAETHYLAMINOAETHYLESTER
99434
BENZOICACID4AMINO3BUTOXY2(DIETHYLAMINO)ETHYLESTER
BENZOICACID4AMINO3BUTOXY2(DIETHYLAMINO)ETHYLESTER(7CI8CI9CI)
BUTOXYAMINOBENZOYLDIETHYLAMINOETHANOL
BUTOXYPROCAINE
CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)N
InChI=1SC17H28N2O3c1471121161314(8915(16)18)17(20)22121019(52)63h8913H47101218H213H3
BBL003344
Synonyms: dibenzo[b,d]furan-4-carboxylicacid
Smiles: OC(=O)c1cccc2c1oc1c2cccc1
OC(=O)c1cccc2c1oc1c2cccc1
ZINC000003850975
ZINC3850975
2786052
4DIBENZOFURANCARBOXYLICACID
DIBENZO(B)FURAN4CARBOXYLICACID
DIBENZO(BD)FURAN4CARBOXYLICACID
DIBENZOFURAN4CARBOXYLICACID
MFCD00092335
C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C(=O)O
InChI=1SC13H8O3c1413(15)1063598412711(8)1612(9)10h17H(H1415)
BBL003345
Synonyms: 5-bromo-1-(2-phenylethyl)-1H-indole-2,3-dione
Smiles: Brc1ccc2c(c1)C(=O)C(=O)N2CCc1ccccc1
Brc1ccc2c(c1)C(=O)C(=O)N2CCc1ccccc1
MFCD00740106
ZINC02941174
ZINC2941174
328002466
5BROMO1(2PHENYLETHYL)1HINDOLE23DIONE
5BROMO1(2PHENYLETHYL)BENZO(D)AZOLIDINE23DIONE
5BROMO1(2PHENYLETHYL)BENZO(D)AZOLINE23DIONE
5BROMO1PHENETHYLINDOLE23DIONE
5bromo1(2phenylethyl)indole23dione
C1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)Br)C(=O)C2=O
InChI=1SC16H12BrNO2c1712671413(1012)15(19)16(20)18(14)98114213511h1710H89H2
BBL003346
Synonyms: N-(2-hydroxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
Smiles: O=C(C1CC(=O)N(C1)c1ccccc1)Nc1ccccc1O
O=C(C1CC(=O)N(C1)c1ccccc1)Nc1ccccc1O
N(2HYDROXYPHENYL)5OXO1PHENYLPYRROLIDINE3CARBOXAMIDE
591213284
C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3O
InChI=1SC17H16N2O3c2015954814(15)1817(22)121016(21)19(1112)136213713h191220H1011H2(H1822)
BBL003347
Synonyms: 4-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-6-methylpyridin-2(1H)-one
Smiles: Oc1cc(C)n(c(=O)c1)CCCn1cncc1
Oc1cc(C)n(c(=O)c1)CCCn1cncc1
ZINC15937677
2HYDROXY1(3IMIDAZOL1YLPROPYL)6METHYLPYRIDIN4ONE
4HYDROXY1(3(1HIMIDAZOL1YL)PROPYL)6METHYLPYRIDIN2(1H)ONE
4HYDROXY1(3IMIDAZOLYLPROPYL)6METHYLHYDROPYRIDIN2ONE
758700606
4hydroxy1(3imidazol1ylpropyl)6methylpyridin2one
CC1=CC(=CC(=O)N1CCCN2C=CN=C2)O
InChI=1SC12H15N3O2c110711(16)812(17)15(10)524146313914h36916H245H21H3
BBL003348
Synonyms: 4-[5-amino-3-(methoxymethyl)-4-phenyl-1H-pyrazol-1-yl]benzoicacid
Smiles: COCc1nn(c(c1c1ccccc1)N)c1ccc(cc1)C(=O)O
COCc1nn(c(c1c1ccccc1)N)c1ccc(cc1)C(=O)O
ZINC4806364
4(5AMINO3(METHOXYMETHYL)4PHENYL1HPYRAZOL1YL)BENZOICACID
4(5AMINO3(METHOXYMETHYL)4PHENYLPYRAZOL1YL)BENZOICACID
895011264
COCC1=NN(C(=C1C2=CC=CC=C2)N)C3=CC=C(C=C3)C(=O)O
InChI=1SC18H17N3O3c124111516(125324612)17(19)21(2015)149713(81014)18(22)23h210H1119H21H3(H2223)
BBL003349
Synonyms: 2-(4-chlorophenyl)-4-methoxy-3-oxobutanenitrile
Smiles: COCC(=O)C(c1ccc(cc1)Cl)C#N
COCC(=O)C(c1ccc(cc1)Cl)C#N
2(4CHLOROPHENYL)4METHOXY3OXOBUTANENITRILE
714258363
COCC(=O)C(C#N)C1=CC=C(C=C1)Cl
InChI=1SC11H10ClNO2c115711(14)10(613)8249(12)538h2510H7H21H3
BBL003350
Synonyms: 4-[(1E)-2-cyano-4,4-dimethyl-3-oxopent-1-en-1-yl]phenyl4-bromobenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)Br)/C(=O)C(C)(C)C
N#CC(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)Br)C(=O)C(C)(C)C
ZINC09668266
ZINC9668266
4((1E)2CYANO44DIMETHYL3OXOPENT1EN1YL)PHENYL4BROMOBENZOATE
892710724
(4((E)2cyano44dimethyl3oxopent1enyl)phenyl)4bromobenzoate
CC(C)(C)C(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)Br)C#N
InChI=1SC21H18BrNO3c121(23)19(24)16(1323)121441018(11514)2620(25)156817(22)9715h412H13H3b1612+
BBL003351
Synonyms: ethyl4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1nc(cc1N)C
CCOC(=O)c1ccc(cc1)n1nc(cc1N)C
ETHYL4(5AMINO3METHYL1HPYRAZOL1YL)BENZOATE
ZINC35655371
BBL003352
Synonyms: 1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-4,4,4-trifluorobutane-1,3-dione
Smiles: O=C(c1ccc(cc1)OCc1c(F)cccc1Cl)CC(=O)C(F)(F)F
O=C(c1ccc(cc1)OCc1c(F)cccc1Cl)CC(=O)C(F)(F)F
ZINC101175583
1(4((2CHLORO6FLUOROBENZYL)OXY)PHENYL)444TRIFLUOROBUTANE13DIONE
1160245691
1(4((2chloro6fluorophenyl)methoxy)phenyl)444trifluorobutane13dione
C1=CC(=C(C(=C1)Cl)COC2=CC=C(C=C2)C(=O)CC(=O)C(F)(F)F)F
InChI=1SC17H11ClF4O3c181321314(19)12(13)925116410(5711)15(23)816(24)17(2021)22h17H89H2
BBL003353
Synonyms: 1-(2-chlorophenyl)-3-(4-chlorophenyl)-1H-pyrazol-5-amine
Smiles: Clc1ccc(cc1)c1nn(c(c1)N)c1ccccc1Cl
Clc1ccc(cc1)c1nn(c(c1)N)c1ccccc1Cl
1020237415
ZINC35655375
1(2CHLOROPHENYL)3(4CHLOROPHENYL)1HPYRAZOL5AMINE
2(2chlorophenyl)5(4chlorophenyl)pyrazol3amine
C1=CC=C(C(=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)N)Cl
InChI=1SC15H11Cl2N3c16117510(6811)13915(18)20(1913)14421312(14)17h19H18H2
BBL003354
Synonyms: 2-(chloromethyl)-3-(2-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccccc1n1c(CCl)nc2c(c1=O)cccc2
COc1ccccc1n1c(CCl)nc2c(c1=O)cccc2
2(CHLOROMETHYL)3(2METHOXYPHENYL)3HYDROQUINAZOLIN4ONE
2(CHLOROMETHYL)3(2METHOXYPHENYL)QUINAZOLIN4(3H)ONE
2(CHLOROMETHYL)3(2METHOXYPHENYL)QUINAZOLIN4ONE
22312818
2CHLOROMETHYL3(2METHOXYPHENYL)3HQUINAZOLIN4ONE
MFCD00767021
ZINC000001441900
ZINC01441900
ZINC1441900
COC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CCl
InChI=1SC16H13ClN2O2c12114954813(14)1915(1017)1812732611(12)16(19)20h29H10H21H3
BBL003355
Synonyms: 2-(diethylamino)ethyl3-amino-4-propoxybenzoate
Smiles: CCCOc1ccc(cc1N)C(=O)OCCN(CC)CC
CCCOc1ccc(cc1N)C(=O)OCCN(CC)CC
DIOCAINE
2(DIETHYLAMINO)ETHYL3AMINO4PROPOXYBENZOATE
2DIETHYLAMINOETHYL3AMINO4PROPOXYBENZOATE
PROXYMETHACAINEHYDROCHLORIDECHIBROKERACAINEFLUORACAINE2(DIETHYLAMINO)ETHYL3AMINO4PROPOXYBENZOATE3AMINO4PROPOXYBENZOICACID2(DIETHYLAMINO)ETHYLESTER
SPECTROCAINE
ZINC000001530762
ZINC1530762
3AMINO4PROPOXYBENZOICACID2(DIETHYLAMINO)ETHYLESTER
3AMINO4PROPOXYBENZOICACID2DIETHYLAMINOETHYLESTERHYDROCHLORIDE
499672
BENZOICACID3AMINO4PROPOXY2(DIETHYLAMINO)ETHYLESTER
BETA(DIETHYLAMINO)ETHYL4NPROPOXYBENZOATE
MFCD00864455
OPHTHAINE
PARACAINE
PARACAINEREG
PROPARACAINE
PROPARACAINEHCL
PROXIMETACAINA
PROXIMETACAINUM
PROXYMETACAINE
PROXYMETACAINE(INN)
PROXYMETACAINE(INNBAN)
PROXYMETACAINEHCL
PROXYMETACAINUM
PROXYMETACAINUM(INNLATIN)
CCCOC1=C(C=C(C=C1)C(=O)OCCN(CC)CC)N
InChI=1SC16H26N2O3c141020158713(1214(15)17)16(19)2111918(52)63h7812H4691117H213H3
BBL003356
Synonyms: 4-ethyl1-methyl5-amino-1H-pyrazole-1,4-dicarboxylate
Smiles: CCOC(=O)c1cnn(c1N)C(=O)OC
CCOC(=O)c1cnn(c1N)C(=O)OC
ZINC05050304
ZINC5050304
220131599
4ETHYL1METHYL5AMINO1HPYRAZOLE14DICARBOXYLATE
4OETHYL1OMETHYL5AMINOPYRAZOLE14DICARBOXYLATE
CCOC(=O)C1=C(N(N=C1)C(=O)OC)N
InChI=1SC8H11N3O4c13157(12)541011(6(5)9)8(13)142h4H39H212H3
BBL003357
Synonyms: 2-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]acetohydrazide
Smiles: NNC(=O)COc1ccc(cc1n1nc2c(n1)cccc2)C
NNC(=O)COc1ccc(cc1n1nc2c(n1)cccc2)C
ZINC01443206
ZINC1443206
2(2(2H123BENZOTRIAZOL2YL)4METHYLPHENOXY)ACETOHYDRAZIDE
2(2(2HBENZOTRIAZOL2YL)4METHYLPHENOXY)ACETOHYDRAZIDE
2(2(2HYDROBENZOTRIAZOL2YL)4METHYLPHENOXY)ACETOHYDRAZIDE
2(2(BENZOTRIAZOL2YL)4METHYLPHENOXY)ACETOHYDRAZIDE
697239739
CC1=CC(=C(C=C1)OCC(=O)NN)N2N=C3C=CC=CC3=N2
InChI=1SC15H15N5O2c1106714(22915(21)1716)13(810)201811423512(11)1920h28H916H21H3(H1721)
BBL003358
Synonyms: 5-bromo-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylicacid
Smiles: O=c1n(C)c(C(=O)O)c(c(=O)n1C)Br
O=c1n(C)c(C(=O)O)c(c(=O)n1C)Br
5bromo13dimethyl26dioxo1236tetrahydropyrimidine4carboxylicacid
5BROMO13DIMETHYL26DIOXO13DIHYDROPYRIMIDINE4CARBOXYLICACID
5BROMO13DIMETHYL26DIOXOPYRIMIDINE4CARBOXYLICACID
ZINC000002379749
ZINC2379749
13DIMETHYL5BROMOOROTICACID
4623250
MFCD01346688
CN1C(=C(C(=O)N(C1=O)C)Br)C(=O)O
InChI=1SC7H7BrN2O4c194(6(12)13)3(8)5(11)10(2)7(9)14h12H3(H1213)
BBL003359
Synonyms: 1-[4-(benzyloxy)phenyl]-4,4,4-trifluorobutane-1,3-dione
Smiles: O=C(c1ccc(cc1)OCc1ccccc1)CC(=O)C(F)(F)F
O=C(c1ccc(cc1)OCc1ccccc1)CC(=O)C(F)(F)F
ZINC100475856
1(4(BENZYLOXY)PHENYL)444TRIFLUORO13BUTANEDIONE
1(4(BENZYLOXY)PHENYL)444TRIFLUOROBUTANE13DIONE
13BUTANEDIONE444TRIFLUORO1(4(PHENYLMETHOXY)PHENYL)
190020145
444trifluoro1(4phenylmethoxyphenyl)butane13dione
C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)CC(=O)C(F)(F)F
InChI=1SC17H13F3O3c1817(1920)16(22)1015(21)136814(9713)2311124213512h19H1011H2
BBL003360
Synonyms: 1-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]-3-(4-methoxyphenoxy)propan-2-ol
Smiles: COc1ccc(cc1)OCC(CN(C1=NS(=O)(=O)c2c1cccc2)C)O
COc1ccc(cc1)OCC(CN(C1=NS(=O)(=O)c2c1cccc2)C)O
1((11DIOXIDO12BENZOTHIAZOL3YL)(METHYL)AMINO)3(4METHOXYPHENOXY)PROPAN2OL
1((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)3(4METHOXYPHENOXY)PROPAN2OL
591212838
CN(CC(COC1=CC=C(C=C1)OC)O)C2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC18H20N2O5Sc120(1816534617(16)26(2223)1918)1113(21)1225159714(242)81015h3101321H1112H212H3
BBL003361
Synonyms: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethylchloroacetate
Smiles: ClCC(=O)OCCNC1=NS(=O)(=O)c2c1cccc2
ClCC(=O)OCCNC1=NS(=O)(=O)c2c1cccc2
2((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)ETHYLCHLOROACETATE
2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)ETHYLCHLOROACETATE
591212930
ZINC06283395
ZINC6283395
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)ETHYL2CHLOROACETATE
MFCD03215159
ZINC000006283395
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCOC(=O)CCl
InChI=1SC11H11ClN2O4Sc12710(15)18651311831249(8)19(1617)1411h14H57H2(H1314)
BBL003362
Synonyms: 3-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]-N-(4-chlorophenyl)propanamide
Smiles: ClCc1noc(n1)CCC(=O)Nc1ccc(cc1)Cl
ClCc1noc(n1)CCC(=O)Nc1ccc(cc1)Cl
945138512
ZINC19816460
3(3(CHLOROMETHYL)124OXADIAZOL5YL)N(4CHLOROPHENYL)PROPANAMIDE
C1=CC(=CC=C1NC(=O)CCC2=NC(=NO2)CCl)Cl
InChI=1SC12H11Cl2N3O2c137101612(191710)6511(18)159318(14)249h14H57H2(H1518)
BBL003363
Synonyms: (2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-1-(4-chlorophenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)c2ccc(cc2)Cl)ccc1OCc1ccccc1
COc1cc(C=CC(=O)c2ccc(cc2)Cl)ccc1OCc1ccccc1
ZINC06441299
ZINC6441299
(2E)3(4(BENZYLOXY)3METHOXYPHENYL)1(4CHLOROPHENYL)PROP2EN1ONE
557746073
(E)1(4chlorophenyl)3(3methoxy4phenylmethoxyphenyl)prop2en1one
COC1=C(C=CC(=C1)C=CC(=O)C2=CC=C(C=C2)Cl)OCC3=CC=CC=C3
InChI=1SC23H19ClO3c126231517(71321(25)1991120(24)121019)81422(23)2716185324618h215H16H21H3b137+
BBL003364
Synonyms: 4-[(1E)-2-cyano-4,4-dimethyl-3-oxopent-1-en-1-yl]-2-methoxyphenyl2-methylbenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccccc1C)/C(=O)C(C)(C)C
N#CC(=Cc1ccc(c(c1)OC)OC(=O)c1ccccc1C)C(=O)C(C)(C)C
ZINC39315684
4((1E)2CYANO44DIMETHYL3OXOPENT1EN1YL)2METHOXYPHENYL2METHYLBENZOATE
914628709
(4((E)2cyano44dimethyl3oxopent1enyl)2methoxyphenyl)2methylbenzoate
CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)C(C)(C)C)OC
InChI=1SC23H23NO4c115867918(15)22(26)2819111016(1320(19)275)1217(1424)21(25)23(23)4h613H15H3b1712+
BBL003365
Synonyms: (2E)-3-(4-bromophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1ccc(cc1)Br
COc1cc(ccc1OC)C(=O)C=Cc1ccc(cc1)Br
ZINC05005349
ZINC5005349
(2E)3(4BROMOPHENYL)1(34DIMETHOXYPHENYL)PROP2EN1ONE
(E)3(4BROMOPHENYL)1(34DIMETHOXYPHENYL)PROP2EN1ONE
(E)34DIMETHOXY4BROMOCHALCONE
881382758
COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Br)OC
InChI=1SC17H15BrO3c1201610613(1117(16)212)15(19)95123714(18)8412h311H12H3b95+
BBL003366
Synonyms: 2-methoxy-4-[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]phenylbenzenesulfonate
Smiles: COc1cc(/C=C/C(=O)c2ccc(cc2)C)ccc1OS(=O)(=O)c1ccccc1
COc1cc(C=CC(=O)c2ccc(cc2)C)ccc1OS(=O)(=O)c1ccccc1
1207326962
2METHOXY4((1E)3(4METHYLPHENYL)3OXOPROP1EN1YL)PHENYLBENZENESULFONATE
ZINC39315685
(2methoxy4((E)3(4methylphenyl)3oxoprop1enyl)phenyl)benzenesulfonate
CC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)OC
InChI=1SC23H20O5Sc11781219(13917)21(24)141018111522(23(1618)272)2829(2526)206435720h316H12H3b1410+
BBL003367
Synonyms: 4-formylphenyl2,6-difluorobenzoate
Smiles: O=Cc1ccc(cc1)OC(=O)c1c(F)cccc1F
O=Cc1ccc(cc1)OC(=O)c1c(F)cccc1F
ZINC39315686
1207326860
4FORMYLPHENYL26DIFLUOROBENZOATE
(4formylphenyl)26difluorobenzoate
C1=CC(=C(C(=C1)F)C(=O)OC2=CC=C(C=C2)C=O)F
InChI=1SC14H8F2O3c151121312(16)13(11)14(18)1910649(817)5710h18H
BBL003368
Synonyms: 2-iodo-N-methylethanamine
Smiles: CNCCI
CNCCI
NMETHYL2IODOETHANAMINE
NMETHYLN2IODOETHYLAMINE
ZINC16189388
(2IODOETHYL)METHYLAMINE
(2IODOETHYL)METHYLAMINEHYDROIODIDE
2IODONMETHYLETHANAMINE
50491151
InChI=1SC3H8INc15324h5H23H21H3
BBL003369
Synonyms: 5-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylicacid
Smiles: O=c1[nH]c(=O)c(c([nH]1)C(=O)O)C
O=c1(nH)c(=O)c(c((nH)1)C(=O)O)C
5methyl26dioxo1236tetrahydropyrimidine4carboxylicacid
5METHYL26DIOXO13DIHYDROPYRIMIDINE4CARBOXYLICACID
5METHYLOROTICACID
6THYMINECARBOXYLICACID
3993735
4PYRIMIDINECARBOXYLICACID236TETRAHYDRO5METHYL26DIOXO
4PYRIMIDINECARBOXYLICACID26DIHYDROXY5METHYL
4PYRIMIDINECARBOXYLICACID6DIHYDROXY5METHYL
5METHYL24DIOXO1HPYRIMIDINE6CARBOXYLICACID
ZINC1683990
26DIHYDROXY5METHYL4CARBOXYPYRIMIDINE
26DIHYDROXY5METHYL4PYRIMIDINECARBOXYLICACID
26DIHYDROXY5METHYLPYRIMIDINE4CARBOXYLICACID
OROTICACID5METHYL
METHYLOROTICACID
CC1=C(NC(=O)NC1=O)C(=O)O
InChI=1SC6H6N2O4c123(5(10)11)76(12)84(2)9h1H3(H1011)(H278912)
BBL003370
Synonyms: 2-chloro-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]acetamide
Smiles: ClCC(=O)NCc1cc(=O)n(c(=O)n1C)C
ClCC(=O)NCc1cc(=O)n(c(=O)n1C)C
2chloroN((13dimethyl26dioxo1236tetrahydropyrimidin4yl)methyl)acetamide
N((13DIMETHYL26DIOXO(13DIHYDROPYRIMIDIN4YL))METHYL)2CHLOROACETAMIDE
ZINC30834179
1172696999
2chloroN((13dimethyl26dioxopyrimidin4yl)methyl)acetamide
CN1C(=CC(=O)N(C1=O)C)CNC(=O)CCl
InChI=1SC9H12ClN3O3c1126(5117(14)410)38(15)13(2)9(12)16h3H45H212H3(H1114)
BBL003371
Synonyms: 2-amino-N-[2-(3,4-dimethylphenoxy)ethyl]benzamide
Smiles: O=C(c1ccccc1N)NCCOc1ccc(c(c1)C)C
O=C(c1ccccc1N)NCCOc1ccc(c(c1)C)C
ZINC04615095
ZINC4615095
(2AMINOPHENYL)N(2(34DIMETHYLPHENOXY)ETHYL)CARBOXAMIDE
2AMINON(2(34DIMETHYLPHENOXY)ETHYL)BENZAMIDE
902638442
CC1=C(C=C(C=C1)OCCNC(=O)C2=CC=CC=C2N)C
InChI=1SC17H20N2O2c1127814(1113(12)2)211091917(20)15534616(15)18h3811H91018H212H3(H1920)
BBL003372
Synonyms: 2-[4-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)phenyl]ethanamine
Smiles: NCCc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cccc2
NCCc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cccc2
ZINC5648292
(2(4(34DIHYDROISOQUINOLIN2(1H)YLSULFONYL)PHENYL)ETHYL)AMINEHYDROCHLORIDE
2(4(34DIHYDRO1HISOQUINOLIN2YLSULFONYL)PHENYL)ETHANAMINE
2(4(34DIHYDROISOQUINOLIN2(1H)YLSULFONYL)PHENYL)ETHANAMINE
C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)CCN
InChI=1SC17H20N2O2Sc18119145717(8614)22(2021)19121015312416(15)1319h18H91318H2
BBL003373
Synonyms: 2-(3-amino-5-chloro-4-hydroxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(Cc2cc(N)c(c(c2)Cl)O)C(=O)c2c1cccc2
O=C1N(Cc2cc(N)c(c(c2)Cl)O)C(=O)c2c1cccc2
ZINC000001442043
ZINC01442043
ZINC1442043
MFCD05258296
1HISOINDOLE13(2H)DIONE2((3AMINO5CHLORO4HYDROXYPHENYL)METHYL)
2((3AMINO5CHLORO4HYDROXYPHENYL)METHYL)BENZO(C)AZOLIDINE13DIONE
2((3AMINO5CHLORO4HYDROXYPHENYL)METHYL)ISOINDOLE13DIONE
2((3AZANYL5CHLORANYL4OXIDANYLPHENYL)METHYL)ISOINDOLE13DIONE
2(3AMINO5CHLORO4HYDROXYBENZYL)1HISOINDOLE13(2H)DIONE
2(3AMINO5CHLORO4HYDROXYBENZYL)ISOINDOLINE13QUINONE
696650052
C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC(=C(C(=C3)Cl)O)N
InChI=1SC15H11ClN2O3c161158(612(17)13(11)19)71814(20)9312410(9)15(18)21h1619H717H2
BBL003374
Synonyms: (4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2-hydroxyethyl)amino]ethylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)C)/C
OCCNC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)C)C
ZINC000100095609
ZINC100095609
MFCD02208451
(4Z)2(13BENZOTHIAZOL2YL)4(1((2HYDROXYETHYL)AMINO)ETHYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)4(1(2HYDROXYETHYLAMINO)ETHYLIDENE)5METHYLPYRAZOL3ONE
299443564
CC1=NN(C(=O)C1=C(C)NCCO)C2=NC3=CC=CC=C3S2
InChI=1SC15H16N4O2Sc19(167820)1310(2)1819(14(13)21)151711534612(11)2215h361620H78H212H3b139
BBL003375
Synonyms: 2-(1,3-benzothiazol-2-yl)-N-ethylhydrazinecarbothioamide
Smiles: CCNC(=S)NNc1nc2c(s1)cccc2
CCNC(=S)NNc1nc2c(s1)cccc2
1(13BENZOTHIAZOL2YLAMINO)3ETHYLTHIOUREA
2(13BENZOTHIAZOL2YL)NETHYLHYDRAZINECARBOTHIOAMIDE
299169918
MFCD01047499
ZINC000002571734
ZINC02571734
ZINC2571734
CCNC(=S)NNC1=NC2=CC=CC=C2S1
InChI=1SC10H12N4S2c12119(15)13141012753468(7)1610h36H2H21H3(H1214)(H2111315)
BBL003376
Synonyms: 4-[1-(4-aminophenyl)-4,5-dimethyl-1H-imidazol-2-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)c1nc(c(n1c1ccc(cc1)N)C)C
N#Cc1ccc(cc1)c1nc(c(n1c1ccc(cc1)N)C)C
ZINC02553898
ZINC2553898
4(1(4AMINOPHENYL)45DIMETHYL1HIMIDAZOL2YL)BENZONITRILE
4(1(4AMINOPHENYL)45DIMETHYLIMIDAZOL2YL)BENZONITRILE
754234214
CC1=C(N(C(=N1)C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)N)C
InChI=1SC18H16N4c11213(2)22(179716(20)81017)18(2112)155314(1119)4615h310H20H212H3
BBL003377
Synonyms: 4-[2-(4-chlorophenyl)-4,5-dimethyl-1H-imidazol-1-yl]aniline
Smiles: Nc1ccc(cc1)n1c(C)c(nc1c1ccc(cc1)Cl)C
Nc1ccc(cc1)n1c(C)c(nc1c1ccc(cc1)Cl)C
ZINC02553896
ZINC2553896
4(2(4CHLOROPHENYL)45DIMETHYL1HIMIDAZOL1YL)ANILINE
4(2(4CHLOROPHENYL)45DIMETHYL1HIMIDAZOL1YL)PHENYLAMINE
4(2(4CHLOROPHENYL)45DIMETHYLIMIDAZOL1YL)ANILINE
754996286
CC1=C(N(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)N)C
InChI=1SC17H16ClN3c11112(2)21(169715(19)81016)17(2011)133514(18)6413h310H19H212H3
BBL003378
Synonyms: 1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-phenylurea
Smiles: O=C(Nc1ccccc1)NCCc1c[nH]c2c1cc(F)cc2
O=C(Nc1ccccc1)NCCc1c(nH)c2c1cc(F)cc2
ZINC06703359
ZINC6703359
((2(5FLUOROINDOL3YL)ETHYL)AMINO)NBENZAMIDE
1(2(5FLUORO1HINDOL3YL)ETHYL)3PHENYLUREA
892686394
C1=CC=C(C=C1)NC(=O)NCCC2=CNC3=C2C=C(C=C3)F
InChI=1SC17H16FN3Oc1813671615(1013)12(112016)891917(22)21144213514h17101120H89H2(H2192122)
BBL003379
Synonyms: 1-(4-iodo-2-methylphenyl)-1H-pyrrole-2,5-dione
Smiles: Ic1ccc(c(c1)C)N1C(=O)C=CC1=O
Ic1ccc(c(c1)C)N1C(=O)C=CC1=O
ZINC00096770
ZINC96770
1(4IODO2METHYLPHENYL)1HPYRROLE25DIONE
1(4IODO2METHYLPHENYL)25DIHYDRO1HPYRROLE25DIONE
1(4IODO2METHYLPHENYL)AZOLINE25DIONE
1(4IODO2METHYLPHENYL)PYRROLE25DIONE
324580214
CC1=C(C=CC(=C1)I)N2C(=O)C=CC2=O
InChI=1SC11H8INO2c1768(12)239(7)1310(14)4511(13)15h26H1H3
BBL003380
Synonyms: [(5Z)-5-(2,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(OC)ccc1/C=C/1\SC(=S)N(C1=O)CC(=O)O
COc1cc(OC)ccc1C=C1SC(=S)N(C1=O)CC(=O)O
MFCD04004854
ZINC000013343654
ZINC13343654
((5Z)5(24DIMETHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
(5(24DIMETHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
1616632713
2((5Z)5((24DIMETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((24DIMETHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
COC1=CC(=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OC
InChI=1SC14H13NO5S2c1199438(10(69)202)51113(18)15(712(16)17)14(21)2211h36H7H212H3(H1617)b115
BBL003381
Synonyms: ethyl2-amino-5-methyl-4-propylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)sc(c1CCC)C
CCOC(=O)c1c(N)sc(c1CCC)C
ETHYL2AMINO5METHYL4PROPYLTHIOPHENE3CARBOXYLATE
1170921604
MFCD12972298
ZINC000030834182
ZINC30834182
CCCC1=C(SC(=C1C(=O)OCC)N)C
InChI=1SC11H17NO2Sc14687(3)1510(12)9(8)11(13)1452h4612H213H3
BBL003382
Synonyms: 6-(chloromethyl)-N-(2-phenylethyl)-1,3,5-triazine-2,4-diamine
Smiles: ClCc1nc(NCCc2ccccc2)nc(n1)N
ClCc1nc(NCCc2ccccc2)nc(n1)N
(4AMINO6(CHLOROMETHYL)(135TRIAZIN2YL))(2PHENYLETHYL)AMINE
104622266
MFCD05258897
ZINC000001423355
ZINC01423355
ZINC1423355
6(CHLOROMETHYL)2NPHENETHYL135TRIAZINE24DIAMINE
6(CHLOROMETHYL)N(2PHENYLETHYL)135TRIAZINE24DIAMINE
6(chloromethyl)2N(2phenylethyl)135triazine24diamine
C1=CC=C(C=C1)CCNC2=NC(=NC(=N2)N)CCl
InChI=1SC12H14ClN5c138101611(14)1812(1710)15769421359h15H68H2(H31415161718)
BBL003383
Synonyms: ethyl4-(2-amino-6-chlorophenyl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1c(N)cccc1Cl
CCOC(=O)N1CCN(CC1)c1c(N)cccc1Cl
ZINC06659311
ZINC6659311
ETHYL4(2AMINO6CHLOROPHENYL)1PIPERAZINECARBOXYLATE
ETHYL4(2AMINO6CHLOROPHENYL)PIPERAZINE1CARBOXYLATE
ETHYL4(2AMINO6CHLOROPHENYL)PIPERAZINECARBOXYLATE
893774011
CCOC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)N
InChI=1SC13H18ClN3O2c121913(18)178616(7917)1210(14)43511(12)15h35H26915H21H3
BBL003384
Synonyms: methyl(4-amino-2-methoxyphenyl)carbamate
Smiles: COC(=O)Nc1ccc(cc1OC)N
COC(=O)Nc1ccc(cc1OC)N
1923088485
CARBAMICACID(4AMINO2METHOXYPHENYL)METHYLESTER
METHYL(4AMINO2METHOXYPHENYL)CARBAMATE
METHYL(4AMINO2METHOXYPHENYL)CARBAMATEHYDROCHLORIDE
METHYL4AMINO2METHOXYPHENYLCARBAMATE
MFCD09063215
N(4AMINO2METHOXYPHENYL)METHOXYCARBOXAMIDE
ZINC000012418957
ZINC12418957
methylN(4amino2methoxyphenyl)carbamate
COC1=C(C=CC(=C1)N)NC(=O)OC
InChI=1SC9H12N2O3c113856(10)347(8)119(12)142h35H10H212H3(H1112)
BBL003385
Synonyms: (1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2[C@H](C)NCCc2cc1OC
COc1cc2(C@H)(C)NCCc2cc1OC
(1S)67dimethoxy1methyl1234tetrahydroisoquinoline
(S)()SALSOLIDINE
493481
SALSOLIDIN
ZINC3900766
(S)SALSOLIDINE
()SALSOLIDINE
CC1C2=CC(=C(C=C2CCN1)OC)OC
InChI=1SC12H17NO2c1810712(153)11(142)69(10)45138h6813H45H213H3t8m0s1
BBL003386
Synonyms: (1S)-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-ol
Smiles: COc1cc2[C@H](C)NCCc2cc1O
COc1cc2(C@H)(C)NCCc2cc1O
(1S)7methoxy1methyl1234tetrahydroisoquinolin6ol
89316
()SALSOLINE
ZINC3683317
CC1C2=CC(=C(C=C2CCN1)O)OC
InChI=1SC11H15NO2c179611(142)10(13)58(9)34127h571213H34H212H3t7m0s1
BBL003387
Synonyms: 5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)furan-2-carbohydrazide
Smiles: NNC(=O)c1ccc(o1)C12CC3CC(C2)CC(C1)C3
NNC(=O)c1ccc(o1)C12CC3CC(C2)CC(C1)C3
5(tricyclo(3311~37~)dec1yl)furan2carbohydrazide
MFCD07626327
ZINC000016430402
ZINC16430402
2ADAMANTANYLFURAN5CARBOHYDRAZIDE
5(1ADAMANTYL)2FUROHYDRAZIDE
5(ADAMANTAN1YL)FURAN2CARBOHYDRAZIDE
897545050
5(1adamantyl)furan2carbohydrazide
C1C2CC3CC1CC(C2)(C3)C4=CC=C(O4)C(=O)NN
InChI=1SC15H20N2O2c161714(18)121213(1912)1569310(715)511(49)815h12911H3816H2(H1718)
BBL003388
Synonyms: 2-hydroxy-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzoicacid
Smiles: OC(=O)c1cc(ccc1O)C12CC3CC(C2)CC(C1)C3
OC(=O)c1cc(ccc1O)C12CC3CC(C2)CC(C1)C3
2hydroxy5(tricyclo(3311~37~)dec1yl)benzoicacid
5(1ADAMANTYL)2HYDROXYBENZOICACID
5(ADAMANTAN1YL)2HYDROXYBENZOICACID
5(ADAMANTYL1)SALICYLICACID
5ADAMANTAN1YL2HYDROXYBENZOICACID
5ADAMANTANYL2HYDROXYBENZOICACID
ZINC000003864420
ZINC3864420
126145515
MFCD00194285
C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)O)C(=O)O
InChI=1SC17H20O3c18152113(614(15)16(19)20)17710311(817)512(410)917h126101218H3579H2(H1920)
BBL003389
Synonyms: (3,5-dimethyltricyclo[3.3.1.1~3,7~]dec-1-yl)aceticacid
Smiles: OC(=O)CC12CC3CC(C2)(CC(C1)(C3)C)C
OC(=O)CC12CC3CC(C2)(CC(C1)(C3)C)C
(35dimethyltricyclo(3311~37~)dec1yl)aceticacid
14202143
2(35DIMETHYL1ADAMANTYL)ACETICACID
2(35DIMETHYLADAMANTAN1YL)ACETICACID
2(35DIMETHYLADAMANTANYL)ACETICACID
35DIMETHYL1ADAMANTANEACETICACID
35DIMETHYLADAMANTANE1ACETICACID
35DIMETHYLADAMANTANEACETICACID
(35DIMETHYL1ADAMANTYL)ACETICACID
(35DIMETHYLADAMANTAN1YL)ACETICACID
CC12CC3CC(C1)(CC(C3)(C2)CC(=O)O)C
InChI=1SC14H22O2c112310413(2712)914(510812)611(15)16h10H39H212H3(H1516)
BBL003390
Synonyms: 1-[3-(3,4-dimethylphenyl)tricyclo[3.3.1.1~3,7~]dec-1-yl]methanamine
Smiles: NCC12CC3CC(C1)CC(C2)(C3)c1ccc(c(c1)C)C
NCC12CC3CC(C1)CC(C2)(C3)c1ccc(c(c1)C)C
1(3(34dimethylphenyl)tricyclo(3311~37~)dec1yl)methanamine
400749851
C(3(34DIMETHYLPHENYL)ADAMANTAN1YL)METHYLAMINE
((3(34DIMETHYLPHENYL)1ADAMANTYL)METHYL)AMINEHYDROCHLORIDE
(3(34DIMETHYLPHENYL)1ADAMANTYL)METHANAMINE
(3(34DIMETHYLPHENYL)1ADAMANTYL)METHYLAMINE
(3(34DIMETHYLPHENYL)ADAMANTAN1YL)METHANAMINE
(3(34DIMETHYLPHENYL)ADAMANTANYL)METHYLAMINE
CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CN)C
InChI=1SC19H27Nc1133417(514(13)2)19915616(1019)818(7151119)1220h351516H61220H212H3
BBL003391
Synonyms: 2-ethyl-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)aniline
Smiles: CCc1ccc(cc1N)C12CC3CC(C2)CC(C1)C3
CCc1ccc(cc1N)C12CC3CC(C2)CC(C1)C3
2ethyl5(tricyclo(3311~37~)dec1yl)aniline
5(1ADAMANTYL)2ETHYLANILINE
5(ADAMANTAN1YL)2ETHYLANILINE
5ADAMANTANYL2ETHYLPHENYLAMINE
696621804
MFCD05855100
ZINC000004628645
ZINC04628645
ZINC4628645
(5(1ADAMANTYL)2ETHYLPHENYL)AMINE
CCC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)C3)N
InChI=1SC18H25Nc12153416(817(15)19)18912513(1018)714(612)1118h3481214H25791119H21H3
BBL003392
Synonyms: 2-methyl-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)aniline
Smiles: Cc1ccc(cc1N)C12CC3CC(C2)CC(C1)C3
Cc1ccc(cc1N)C12CC3CC(C2)CC(C1)C3
2methyl5(tricyclo(3311~37~)dec1yl)aniline
5(1ADAMANTYL)2METHYLANILINE
5(ADAMANTAN1YL)2METHYLANILINE
5ADAMANTANYL2METHYLPHENYLAMINE
(5(1ADAMANTYL)2METHYLPHENYL)AMINEHYDROCHLORIDE
26378314
MFCD01837700
ZINC000003878713
ZINC03878713
ZINC3878713
CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)C3)N
InChI=1SC17H23Nc1112315(716(11)18)17812413(917)614(512)1017h2371214H4681018H21H3
BBL003393
Synonyms: N-(2-chloroethyl)tricyclo[3.3.1.1~3,7~]decan-2-amine
Smiles: ClCCNC1C2CC3CC1CC(C2)C3
ClCCNC1C2CC3CC1CC(C2)C3
N(2chloroethyl)tricyclo(3311~37~)decan2amine
ZINC000012362970
ZINC12362970
MFCD09063093
924843345
ADAMANTAN2YL(2CHLOROETHYL)AMINE
N(2CHLOROETHYL)ADAMANTAN2AMINEHYDROCHLORIDE
N(2chloroethyl)adamantan2amine
C1C2CC3CC1CC(C2)C3NCCCl
InChI=1SC12H20ClNc13121412104839(610)711(12)58h81214H17H2
BBL003394
Synonyms: 3-(tricyclo[3.3.1.1~3,7~]dec-1-ylsulfanyl)-1,2,4-thiadiazol-5-amine
Smiles: Nc1snc(n1)SC12CC3CC(C2)CC(C1)C3
Nc1snc(n1)SC12CC3CC(C2)CC(C1)C3
3(tricyclo(3311~37~)dec1ylsulfanyl)124thiadiazol5amine
3ADAMANTANYLTHIO124THIADIAZOLE5YLAMINE
727676304
(124)THIADIAZOLE5AMINO3(ADAMANTAN1YLSULFANYL)
3(1ADAMANTYLSULFANYL)124THIADIAZOL5AMINE
3(1ADAMANTYLTHIO)124THIADIAZOL5AMINE
3(ADAMANTAN1YLSULFANYL)(124)THIADIAZOL5YLAMINE
3(ADAMANTAN1YLSULFANYL)124THIADIAZOL5AMINE
ZINC000001431685
ZINC01431685
ZINC1431685
MFCD06013313
C1C2CC3CC1CC(C2)(C3)SC4=NSC(=N4)N
InChI=1SC12H17N3S2c13101411(151710)16124718(512)39(27)612h79H16H2(H2131415)
BBL003395
Synonyms: 4-methoxy-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzoicacid
Smiles: COc1ccc(cc1C12CC3CC(C2)CC(C1)C3)C(=O)O
COc1ccc(cc1C12CC3CC(C2)CC(C1)C3)C(=O)O
4methoxy3(tricyclo(3311~37~)dec1yl)benzoicacid
104224626
3(1ADAMANTYL)4METHOXYBENZOICACID
3(ADAMANTAN1YL)4METHOXYBENZOICACID
3ADAMANTAN1YL4METHOXYBENZOICACID
3ADAMANTANYL4METHOXYBENZOICACID
MFCD06014128
ZINC000004718122
ZINC4718122
COC1=C(C=C(C=C1)C(=O)O)C23CC4CC(C2)CC(C4)C3
InChI=1SC18H22O3c121163214(17(19)20)715(16)18811412(918)613(511)1018h2371113H46810H21H3(H1920)
BBL003396
Synonyms: 4,5-dimethoxy-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)aniline
Smiles: COc1cc(c(cc1OC)N)C12CC3CC(C2)CC(C1)C3
COc1cc(c(cc1OC)N)C12CC3CC(C2)CC(C1)C3
45dimethoxy2(tricyclo(3311~37~)dec1yl)aniline
ZINC12418143
(2(1ADAMANTYL)45DIMETHOXYPHENYL)AMINE
2(1ADAMANTYL)45DIMETHOXYANILINE
2(ADAMANTAN1YL)45DIMETHOXYANILINE
2ADAMANTANYL45DIMETHOXYPHENYLAMINE
931587869
COC1=C(C=C(C(=C1)C23CC4CC(C2)CC(C4)C3)N)OC
InChI=1SC18H25NO2c12016614(15(19)717(16)212)18811312(918)513(411)1018h671113H3581019H212H3
BBL003397
Synonyms: 2-(tricyclo[3.3.1.1~3,7~]dec-2-yl)ethanamine
Smiles: NCCC1C2CC3CC1CC(C2)C3
NCCC1C2CC3CC1CC(C2)C3
2(tricyclo(3311~37~)dec2yl)ethanamine
2ADAMANTAN2YLETHYLAMINE
2ADAMANTIL2ETILAMMINA
2ADAMANTYL2ETHYLAMINE
59807555
(2(2ADAMANTYL)ETHYL)AMINEHYDROCHLORIDE
2(2AMINOETHYL)ADAMANTANE
2(ADAMANT2YL)ETHYLAMINE
2(ADAMANTAN2YL)ETHAN1AMINE
2(ADAMANTAN2YL)ETHANAMINE
ZINC000001859111
ZINC1859111
2(2ADAMANTYL)ETHANAMINE
2(2ADAMANTYL)ETHYLAMINE
2(2ADAMANTYL)ETHYLAMINEHYDROCHLORIDE
MFCD01678011
C1C2CC3CC1CC(C2)C3CCN
InChI=1SC12H21Nc132112104839(610)711(12)58h812H1713H2
BBL003398
Synonyms: 2-(tricyclo[3.3.1.1~3,7~]dec-1-ylsulfanyl)ethanamine
Smiles: NCCSC12CC3CC(C2)CC(C1)C3
NCCSC12CC3CC(C2)CC(C1)C3
2(tricyclo(3311~37~)dec1ylsulfanyl)ethanamine
2ADAMANTANYLTHIOETHYLAMINE
30771870
(2(1ADAMANTYLTHIO)ETHYL)AMINEHYDROCHLORIDE
2(1ADAMANTYLSULFANYL)ETHANAMINE
2(1ADAMANTYLTHIO)ETHANAMINE
2(1ADAMANTYLTHIO)ETHYLAMINE
2(ADAMANTAN1YLSULFANYL)ETHYLAMINE
S(1ADAMANTYL)MERCAPTOETHYLAMINE
ZINC000001733109
ZINC1733109
MFCD01821209
C1C2CC3CC1CC(C2)(C3)SCCN
InChI=1SC12H21NSc1312141269310(712)511(49)812h911H1813H2
BBL003399
Synonyms: 5-chloro-1H-benzimidazole-2-thiol
Smiles: Clc1ccc2c(c1)nc([nH]2)S
Clc1ccc2c(c1)nc((nH)2)S
25369782
2BENZIMIDAZOLETHIOL5CHLORO
MFCD01658762
ZINC000003881191
ZINC03881191
ZINC3881191
2BENZIMIDAZOLETHIOL5CHLORO(8CI)
2BENZIMIDAZOLINETHIONE5CHLORO
2HBENZIMIDAZOLE2THIONE5CHLORO13DIHYDRO
2HBENZIMIDAZOLE2THIONE5CHLORO13DIHYDRO(9CI)
2MERCAPTO5CHLOROBENZIMIDAZOLE
5CHLORANYL13DIHYDROBENZIMIDAZOLE2THIONE
5CHLORO13DIHYDRO2HBENZIMIDAZOLE2THIONE
5CHLORO13DIHYDROBENZIMIDAZOLE2THIONE
5CHLORO1HBENZIMIDAZOLE2THIOL
5CHLORO1HBENZOIMIDAZOLE2THIOL
5CHLORO2(3)BENZIMIDAZOLETHIONE
5CHLORO23DIHYDRO1H13BENZODIAZOLE2THIONE
5CHLORO2BENZIMIDAZOLETHIOL
5CHLORO2MERCAPTOBENZIMIDAZOLE
5CHLORO2MERCAPTOBENZIMIDAZOLE98
5CHLORO3H13BENZODIAZOLE2THIOL
5CHLOROBENZIMIDAZOLE2THIOL
6CHLORO1H13BENZODIAZOLE2THIOL
6CHLORO1HBENZIMIDAZOLE2THIOL
6CHLORO1HBENZO(D)IMIDAZOLE2THIOL
6CHLORO1HBENZOIMIDAZOLE2THIOL
6CHLORO2MERCAPTOBENZIMIDAZOLE
C1=CC2=C(C=C1Cl)NC(=S)N2
InChI=1SC7H5ClN2Sc841256(34)107(11)95h13H(H291011)
BBL003400
Synonyms: 3-(3,4,5-trimethoxyphenyl)propanoicacid
Smiles: COc1cc(CCC(=O)O)cc(c1OC)OC
COc1cc(CCC(=O)O)cc(c1OC)OC
MFCD00002775
ZINC000000073032
ZINC73032
345TRIMETHOXYBENZENEPROPANOICACID
25173722
3(345TRIMETHOXYPHENYL)PROPANOICACID
3(345TRIMETHOXYPHENYL)PROPIONICACID
345TRIMETHOXYDIHYDROCINNAMICACID
345TRIMETHOXYHYDROCINNAMICACID
345TRIMETHOXYPHENYLPROPIONICACID
BENZENEPROPANOICACID345TRIMETHOXY
BETA(345TRIMETHOXYPHENYL)PROPIONICACID
COC1=CC(=CC(=C1OC)OC)CCC(=O)O
InChI=1SC12H16O5c115968(4511(13)14)710(162)12(9)173h67H45H213H3(H1314)
BBL003401
Synonyms: 4-nitrobenzohydrazide
Smiles: NNC(=O)c1ccc(cc1)[N+](=O)[O-]
NNC(=O)c1ccc(cc1)(N+)(=O)(O)
PNITROBENZHYDRAZIDE
PNITROBENZOHYDRAZIDE
PNITROBENZOICACIDHYDRAZIDE
PNITROBENZOICHYDRAZIDE
PNITROBENZOYLHYDRAZIDE
4NITROBENZENECARBOHYDRAZIDE
4NITROBENZHYDRAZIDE
4NITROBENZOHYDRAZIDE
4NITROBENZOICACIDHYDRAZIDE
4NITROBENZOICHYDRAZIDE
4NITROBENZOICHYDRAZINE
ZINC000000504383
(4NITROBENZOYL)HYDRAZIDE
(4NITROBENZOYL)HYDRAZINE
ZINC00504383
ZINC504383
(PNITROBENZOYL)HYDRAZINE
1NITROBENZENE4CARBOHYDRAZIDE
4NITROBENZOYLHYDRAZIDE
4NITROBENZOYLHYDRAZINE
636975
BENZOICACID4NITROHYDRAZIDE
BENZOICACIDPNITROHYDRAZIDE
MFCD00007604
C1=CC(=CC=C1C(=O)NN)(N+)(=O)(O)
InChI=1SC7H7N3O3c897(11)5136(425)10(12)13h14H8H2(H911)
BBL003402
Synonyms: 3-(3-hydroxyphenyl)-1,3-oxazolidin-2-one
Smiles: Oc1cccc(c1)N1CCOC1=O
Oc1cccc(c1)N1CCOC1=O
ZINC19093329
1038713379
3(3HYDROXYPHENYL)13OXAZOLIDIN2ONE
3(3HYDROXYPHENYL)OXAZOLIDIN2ONE
C1COC(=O)N1C2=CC(=CC=C2)O
InChI=1SC9H9NO3c1183127(68)1045139(10)12h13611H45H2
BBL003403
Synonyms: 1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde
Smiles: O=Cc1c(C)n(n(c1=O)c1ccccc1)C
O=Cc1c(C)n(n(c1=O)c1ccccc1)C
ZINC00119347
ZINC119347
((1R2S5R)2ISOPROPENYL5METHYLCYCLOHEXYL)ACETATE
15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOLE4CARBALDEHYDE
15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOLE4CARBOXALDEHYDE
15DIMETHYL3OXO2PHENYLPYRAZOLE4CARBALDEHYDE
1HPYRAZOLE4CARBOXALDEHYDE23DIHYDRO15DIMETHYL3OXO2PHENYL
1HPYRAZOLE4CARBOXALDEHYDE3DIHYDRO15DIMETHYL3OXO2PHENYL
1PHENYL23DIMETHYL4FORMYL3PYRAZOLINE5ONE
23DIHYDRO15DIMETHYL3OXO2PHENYL1HPYRAZOLE4CARBALDEHYDE
23DIHYDRO15DIMETHYL3OXO2PHENYL1HPYRAZOLE4CARBOXALDEHYDE
23DIHYDRO15DIMETHYL4FORMYL3OXO2PHENYL1HPYRAZOLE
23DIMETHYL5OXO1PHENYL3PYRAZOLINE4CARBALDEHYDE
23DIMETHYL5OXO1PHENYL3PYRAZOLINE4CARBOXALDEHYDE
4ANTIPYRINECARBALDEHYDE
4ANTIPYRINECARBOXALDEHYDE
4FORMYLANTIPYRINE
950812
ANTIPYRALDEHYDE
ANTIPYRINALDEHYD
ANTIPYRINE4CARBOXALDEHYDE
ANTIPYRINE4FORMYL
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=O
InChI=1SC12H12N2O2c1911(815)12(16)14(13(9)2)106435710h38H12H3
BBL003404
Synonyms: 2,4,6-trimethylpyridin-3-amine
Smiles: Cc1cc(C)c(c(n1)C)N
Cc1cc(C)c(c(n1)C)N
ZINC01421950
ZINC1421950
246TRIMETHYL3AMINOPYRIDINE
246TRIMETHYL3PYRIDYLAMINE
246TRIMETHYLPYRIDIN3AMIN
246TRIMETHYLPYRIDIN3AMINE
246TRIMETHYLPYRIDIN3YLAMINE
3AMINO246TRIMETHYLPYRIDINE
3PYRIDINAMINE246TRIMETHYL
51467700
CC1=CC(=NC(=C1N)C)C
InChI=1SC8H12N2c1546(2)107(3)8(5)9h4H9H213H3
BBL003405
Synonyms: 2-(4-chloro-2-methylphenoxy)ethanamine
Smiles: NCCOc1ccc(cc1C)Cl
NCCOc1ccc(cc1C)Cl
ZINC000002171893
ZINC2171893
MFCD03819342
(2(4CHLORO2METHYLPHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(4CHLORO2METHYLPHENOXY)ETHANAMINE
2(4CHLORO2METHYLPHENOXY)ETHYLAMINE
857624294
CC1=C(C=CC(=C1)Cl)OCCN
InChI=1SC9H12ClNOc1768(10)239(7)125411h236H4511H21H3
BBL003406
Synonyms: 2-(4-chlorophenoxy)-2-methylpropanehydrazide
Smiles: NNC(=O)C(Oc1ccc(cc1)Cl)(C)C
NNC(=O)C(Oc1ccc(cc1)Cl)(C)C
PROPANOICACID3(4CHLOROPHENOXY)2METHYLHYDRAZIDE
ZINC000000071504
ZINC00071504
ZINC71504
2(4CHLOROPHENOXY)2METHYLPROPANEHYDRAZIDE
2(4CHLOROPHENOXY)2METHYLPROPANOHYDRAZIDE
29771662
MFCD03759757
CC(C)(C(=O)NN)OC1=CC=C(C=C1)Cl
InChI=1SC10H13ClN2O2c110(29(14)1312)158537(11)468h36H12H212H3(H1314)
BBL003407
Synonyms: 1-methyl-5-(trifluoromethyl)-1H-benzimidazol-2-amine
Smiles: Cn1c(N)nc2c1ccc(c2)C(F)(F)F
Cn1c(N)nc2c1ccc(c2)C(F)(F)F
1METHYL5(TRIFLUOROMETHYL)1HBENZIMIDAZOL2AMINE
1METHYL5(TRIFLUOROMETHYL)BENZIMIDAZOLE2YLAMINE
ZINC29866030
1methyl5(trifluoromethyl)benzimidazol2amine
CN1C2=C(C=C(C=C2)C(F)(F)F)N=C1N
InChI=1SC9H8F3N3c1157325(9(1011)12)46(7)148(15)13h24H1H3(H21314)
BBL003408
Synonyms: 4-[2-(pyridin-2-yl)ethyl]aniline
Smiles: Nc1ccc(cc1)CCc1ccccn1
Nc1ccc(cc1)CCc1ccccn1
ZINC01663939
ZINC1663939
(4(2PYRIDIN2YLETHYL)PHENYL)AMINEDIHYDROCHLORIDE
2(2(4AMINOPHENYL)ETHYL)PYRIDINE
4(2(2PYRIDINYL)ETHYL)ANILINE
4(2(2PYRIDINYL)ETHYL)PHENYLAMINE
4(2(2PYRIDYL)ETHYL)PHENYLAMINE
4(2(PYRIDIN2YL)ETHYL)ANILINE
4(2PYRIDIN2YLETHYL)ANILINE
4(2PYRIDIN2YLETHYL)PHENYLAMINE
BENZENAMINE4(2(2PYRIDINYL)ETHYL)
C1=CC=NC(=C1)CCC2=CC=C(C=C2)N
InChI=1SC13H14N2c14127411(5812)6913312101513h157810H6914H2
BBL003409
Synonyms: N-(3-chloro-2-hydroxyphenyl)acetamide
Smiles: CC(=O)Nc1cccc(c1O)Cl
CC(=O)Nc1cccc(c1O)Cl
29473232
N(3CHLORO2HYDROXYPHENYL)ACETAMIDE
ZINC30834322
CC(=O)NC1=C(C(=CC=C1)Cl)O
InChI=1SC8H8ClNO2c15(11)1074236(9)8(7)12h2412H1H3(H1011)
BBL003410
Synonyms: 3-(2-aminophenyl)-1,3-oxazolidin-2-one
Smiles: O=C1OCCN1c1ccccc1N
O=C1OCCN1c1ccccc1N
ZINC19093507
3(2AMINOPHENYL)13OXAZOLIDIN2ONE
313OXAZOLIDIN2ONE
936940544
C1COC(=O)N1C2=CC=CC=C2N
InChI=1SC9H10N2O2c10731248(7)1156139(11)12h14H5610H2
BBL003411
Synonyms: 2,2'-sulfanediylbis(4-chlorophenol)
Smiles: Oc1ccc(cc1Sc1cc(Cl)ccc1O)Cl
Oc1ccc(cc1Sc1cc(Cl)ccc1O)Cl
PHENOL22THIOBIS(4CHLORO
PHENOL2THIOBIS(4CHLORO
22DIHYDROXY55DICHLORODIPHENYLSULFIDE
22DIHYDROXY55DICHLOROPHENYLSULFIDE
ZINC000000136146
ZINC00136146
ZINC136146
S7(ANTIMYCOTIC)
PHENTICHLORUM
22THIOBIS4CHLOROPHENOL
4CHLORANYL2(5CHLORANYL2OXIDANYLPHENYL)SULFANYLPHENOL
4CHLORO2((5CHLORO2HYDROXYPHENYL)SULFANYL)PHENOL
4CHLORO2((5CHLORO2HYDROXYPHENYL)THIO)PHENOL
4CHLORO2(5CHLORO2HYDROXYPHENYL)SULFANYLPHENOL
4CHLORO2(5CHLORO2HYDROXYPHENYLTHIO)PHENOL
52DIHYDROXYDIPHENYLSULFIDE
55DICHLORO22DIHYDROXYDIPHENYLSULFIDE
97245
BIS(2HYDROXY5CHLOROPHENYL)SULFIDE
BIS(5CHLORO2HYDROXYPHENYL)SULFIDE
D25ANTIMYKOTIKUM
FENTICHLOR
FENTICLOR(USANINN)
FENTICLOR(USANINNBAN)
MEFLORIN
MFCD00031479
25DICHLORODIPHENYLSULFIDE
25DICHLOROPHENYLSULFIDE
22SULFANEDIYLBIS(4CHLOROPHENOL)
22THIOBIS(4CHLOROPHENOL)
C1=CC(=C(C=C1Cl)SC2=C(C=CC(=C2)Cl)O)O
InChI=1SC12H8Cl2O2Sc137139(15)11(57)171268(14)2410(12)16h161516H
BBL003412
Synonyms: N-methylhydrazinecarbothioamide
Smiles: CNC(=S)NN
CNC(=S)NN
HYDRAZINECARBOTHIOAMIDENMETHYL
HYDRAZINO(METHYLAMINO)METHANE1THIONE
1AMINO3METHYLTHIOUREA
1METHYL2THIOSEMICARBAZIDE
3AMINO1METHYLTHIOUREA
4METHYL3THIOSEMICARBAZIDE
4METHYLHYDRAZINECARBOTHIOAMIDE
4METHYLTHIOSEMICARBAZIDE
6610293
METHYLTHIOSEMICARBAZIDE
MFCD00007617
NMETHYLHYDRAZINECARBOTHIOAMIDE
NMETHYLTHIOSEMICARBAZIDE
SEMICARBAZIDE4METHYL3THIO
SEMICARBAZIDE4METHYL3THIO(8CI)
ZINC000005187321
ZINC05187321
ZINC5187321
InChI=1SC2H7N3Sc142(6)53h3H21H3(H2456)
BBL003413
Synonyms: 4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methoxybenzyl)amino]phenol
Smiles: COc1ccc(cc1)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)O
COc1ccc(cc1)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)O
ZINC01153113
ZINC1153113
3((4HYDROXYPHENYL)((4METHOXYPHENYL)METHYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
4((11DIOXIDO12BENZISOTHIAZOL3YL)(4METHOXYBENZYL)AMINO)PHENOL
4((11DIOXIDO12BENZOTHIAZOL3YL)(4METHOXYBENZYL)AMINO)PHENOL
4((11DIOXO12BENZOTHIAZOL3YL)((4METHOXYPHENYL)METHYL)AMINO)PHENOL
433254230
COC1=CC=C(C=C1)CN(C2=CC=C(C=C2)O)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H18N2O4Sc1271812615(71318)1423(1681017(24)11916)2119423520(19)28(2526)2221h21324H14H21H3
BBL003414
Synonyms: 4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(thiophen-2-ylmethyl)amino]phenol
Smiles: Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1cccs1
Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)Cc1cccs1
ZINC000000782913
ZINC00782913
ZINC782913
3((4HYDROXYPHENYL)(THIOPHEN2YLMETHYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
4((11DIOXIDO12BENZISOTHIAZOL3YL)(2THIENYLMETHYL)AMINO)PHENOL
4((11DIOXIDO12BENZOTHIAZOL3YL)(THIOPHEN2YLMETHYL)AMINO)PHENOL
4((11DIOXO12BENZOTHIAZOL3YL)(THIOPHEN2YLMETHYL)AMINO)PHENOL
443319388
MFCD03713409
C1=CC=C2C(=C1)C(=NS2(=O)=O)N(CC3=CC=CS3)C4=CC=C(C=C4)O
InChI=1SC18H14N2O3S2c21149713(81014)20(121543112415)1816512617(16)25(2223)1918h11121H12H2
BBL003415
Synonyms: 2-[(naphthalen-1-ylamino)methyl]phenol
Smiles: Oc1ccccc1CNc1cccc2c1cccc2
Oc1ccccc1CNc1cccc2c1cccc2
ZINC00401250
ZINC401250
2((1NAPHTHYL)AMINOMETHYL)PHENOL
2((1NAPHTHYLAMINO)METHYL)PHENOL
2((NAPHTHALEN1YLAMINO)METHYL)PHENOL
351004507
C1=CC=C2C(=C1)C=CC=C2NCC3=CC=CC=C3O
InChI=1SC17H15NOc19171142714(17)121816105813613915(13)16h1111819H12H2
BBL003416
Synonyms: N'-(1,1-dioxido-1,2-benzothiazol-3-yl)-4-methoxybenzenesulfonohydrazide
Smiles: COc1ccc(cc1)S(=O)(=O)NNC1=NS(=O)(=O)c2c1cccc2
COc1ccc(cc1)S(=O)(=O)NNC1=NS(=O)(=O)c2c1cccc2
351066121
N(11DIOXIDO12BENZISOTHIAZOL3YL)4METHOXYBENZENESULFONOHYDRAZIDE
N(11DIOXIDO12BENZOTHIAZOL3YL)4METHOXYBENZENESULFONOHYDRAZIDE
N(11DIOXO12BENZOTHIAZOL3YL)4METHOXYBENZENESULFONOHYDRAZIDE
N(11DIOXO1L(6)2BENZOTHIAZOL3YL)4METHOXYBENZENESULFONOHYDRAZIDE
ZINC06170520
ZINC6170520
COC1=CC=C(C=C1)S(=O)(=O)NNC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC14H13N3O5S2c122106811(9710)23(1819)17151412423513(12)24(2021)1614h2917H1H3(H1516)
BBL003417
Synonyms: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propyl2-bromopropanoate
Smiles: O=C(C(Br)C)OCCCNC1=NS(=O)(=O)c2c1cccc2
O=C(C(Br)C)OCCCNC1=NS(=O)(=O)c2c1cccc2
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PROPYL2BROMOPROPANOATE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PROPYL2BROMOPROPANOATE
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PROPYL2BROMOPROPANOATE
3((11DIOXO1L(6)2BENZOTHIAZOL3YL)AMINO)PROPYL2BROMOPROPANOATE
591213013
CC(C(=O)OCCCNC1=NS(=O)(=O)C2=CC=CC=C21)Br
InChI=1SC13H15BrN2O4Sc19(14)13(17)20847151210523611(10)21(1819)1612h23569H478H21H3(H1516)
BBL003418
Synonyms: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propylchloroacetate
Smiles: ClCC(=O)OCCCNC1=NS(=O)(=O)c2c1cccc2
ClCC(=O)OCCCNC1=NS(=O)(=O)c2c1cccc2
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PROPYLCHLOROACETATE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PROPYLCHLOROACETATE
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PROPYL2CHLOROACETATE
3((11DIOXO1L(6)2BENZOTHIAZOL3YL)AMINO)PROPYL2CHLOROACETATE
591212996
MFCD04083660
ZINC000004289830
ZINC04289830
ZINC4289830
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCOC(=O)CCl
InChI=1SC12H13ClN2O4Sc13811(16)1973614129412510(9)20(1718)1512h1245H368H2(H1415)
BBL003419
Synonyms: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propyl2-bromobutanoate
Smiles: CCC(C(=O)OCCCNC1=NS(=O)(=O)c2c1cccc2)Br
CCC(C(=O)OCCCNC1=NS(=O)(=O)c2c1cccc2)Br
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PROPYL2BROMOBUTANOATE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PROPYL2BROMOBUTANOATE
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PROPYL2BROMOBUTANOATE
3((11DIOXO1L(6)2BENZOTHIAZOL3YL)AMINO)PROPYL2BROMOBUTANOATE
591212974
CCC(C(=O)OCCCNC1=NS(=O)(=O)C2=CC=CC=C21)Br
InChI=1SC14H17BrN2O4Sc1211(15)14(18)21958161310634712(10)22(1920)1713h346711H2589H21H3(H1617)
BBL003420
Synonyms: 2-{[(1,1-dioxido-1,2-benzothiazol-3-yl)(naphthalen-1-yl)amino]methyl}phenol
Smiles: Oc1ccccc1CN(C1=NS(=O)(=O)c2c1cccc2)c1cccc2c1cccc2
Oc1ccccc1CN(C1=NS(=O)(=O)c2c1cccc2)c1cccc2c1cccc2
ZINC01123784
ZINC1123784
2(((11DIOXIDO12BENZISOTHIAZOL3YL)(1NAPHTHYL)AMINO)METHYL)PHENOL
2(((11DIOXIDO12BENZOTHIAZOL3YL)(NAPHTHALEN1YL)AMINO)METHYL)PHENOL
2(((11DIOXO12BENZOTHIAZOL3YL)NAPHTHALEN1YLAMINO)METHYL)PHENOL
3(((2HYDROXYPHENYL)METHYL)(NAPHTHALEN1YL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
442571995
C1=CC=C2C(=C1)C=CC=C2N(CC3=CC=CC=C3O)C4=NS(=O)(=O)C5=CC=CC=C54
InChI=1SC24H18N2O3Sc27221452918(22)1626(2113710178131119(17)21)242012461523(20)30(2829)2524h11527H16H2
BBL003421
Synonyms: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-2-thioxo-1,3-thiazolidin-4-one
Smiles: O=C1CSC(=S)N1NC1=NS(=O)(=O)c2c1cccc2
O=C1CSC(=S)N1NC1=NS(=O)(=O)c2c1cccc2
ZINC000003095329
ZINC03095329
ZINC3095329
MFCD00759414
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)2THIOXO13THIAZOLIDIN4ONE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)2THIOXO13THIAZOLIDIN4ONE
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
3((4OXO2THIOXOTHIAZOLIDIN3YL)AMINO)12BENZISOTHIAZOLE11DIOXIDE
591212770
C1C(=O)N(C(=S)S1)NC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC10H7N3O3S3c14851810(17)13(8)119631247(6)19(1516)129h14H5H2(H1112)
BBL003422
Synonyms: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propylchloro(phenyl)acetate
Smiles: O=C(C(c1ccccc1)Cl)OCCCNC1=NS(=O)(=O)c2c1cccc2
O=C(C(c1ccccc1)Cl)OCCCNC1=NS(=O)(=O)c2c1cccc2
ZINC000002477547
ZINC000002477552
MFCD02315022
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PROPYLCHLORO(PHENYL)ACETATE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PROPYLCHLORO(PHENYL)ACETATE
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PROPYL2CHLORO2PHENYLACETATE
3((11DIOXO1L(6)2BENZOTHIAZOL3YL)AMINO)PROPYL2CHLORO2PHENYLACETATE
3((11DIOXOBENZO(D)12THIAZOLIN3YL)AMINO)PROPYL2CHLORO2PHENYLACETATE
356088589
C1=CC=C(C=C1)C(C(=O)OCCCNC2=NS(=O)(=O)C3=CC=CC=C32)Cl
InChI=1SC18H17ClN2O4Sc1916(137213813)18(22)25126112017149451015(14)26(2324)2117h1571016H61112H2(H2021)
BBL003423
Synonyms: 5-({[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-amine
Smiles: Clc1ccc(cc1)c1occ(n1)CSc1nnc(s1)N
Clc1ccc(cc1)c1occ(n1)CSc1nnc(s1)N
5(((2(4CHLOROPHENYL)13OXAZOL4YL)METHYL)SULFANYL)134THIADIAZOL2AMINE
5(((2(4CHLOROPHENYL)13OXAZOL4YL)METHYL)THIO)134THIADIAZOL2AMINE
5((2(4CHLOROPHENYL)13OXAZOL4YL)METHYLSULFANYL)134THIADIAZOL2AMINE
792940784
MFCD05999018
ZINC000002867171
ZINC02867171
ZINC2867171
C1=CC(=CC=C1C2=NC(=CO2)CSC3=NN=C(S3)N)Cl
InChI=1SC12H9ClN4OS2c138317(248)10159(51810)61912171611(14)2012h15H6H2(H21416)
BBL003424
Synonyms: 2-{[1,2-dihydroacenaphthylen-5-yl(1,1-dioxido-1,2-benzothiazol-3-yl)amino]methyl}phenol
Smiles: Oc1ccccc1CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc2c3c1cccc3CC2
Oc1ccccc1CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc2c3c1cccc3CC2
ZINC000001158584
ZINC01158584
ZINC1158584
3(12DIHYDROACENAPHTHYLEN5YL((2HYDROXYPHENYL)METHYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
2((12DIHYDROACENAPHTHYLEN5YL(11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)METHYL)PHENOL
2((12DIHYDROACENAPHTHYLEN5YL(11DIOXIDO12BENZOTHIAZOL3YL)AMINO)METHYL)PHENOL
2((12DIHYDROACENAPHTHYLEN5YL(11DIOXO12BENZOTHIAZOL3YL)AMINO)METHYL)PHENOL
433971121
MFCD03708174
C1CC2=CC=CC3=C(C=CC1=C23)N(CC4=CC=CC=C4O)C5=NS(=O)(=O)C6=CC=CC=C65
InChI=1SC26H20N2O3Sc29231031619(23)1628(26218241124(21)32(3031)2726)2215141813121775920(22)25(17)18h111141529H121316H2
BBL003425
Synonyms: 4-{[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]methyl}-2-methoxyphenol
Smiles: COc1cc(ccc1O)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)C
COc1cc(ccc1O)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)C
ZINC04561770
ZINC4561770
3(((4HYDROXY3METHOXYPHENYL)METHYL)(4METHYLPHENYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
4(((11DIOXIDO12BENZISOTHIAZOL3YL)(4METHYLPHENYL)AMINO)METHYL)2METHOXYPHENOL
4(((11DIOXIDO12BENZOTHIAZOL3YL)(4METHYLPHENYL)AMINO)METHYL)2METHOXYPHENOL
4((N(11DIOXO12BENZOTHIAZOL3YL)4METHYLANILINO)METHYL)2METHOXYPHENOL
433941925
CC1=CC=C(C=C1)N(CC2=CC(=C(C=C2)O)OC)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC22H20N2O4Sc11571017(11815)24(141691219(25)20(1316)282)2218534621(18)29(2627)2322h31325H14H212H3
BBL003426
Synonyms: 5,6-dimethyl-1H-benzimidazole-2-thiol
Smiles: Sc1[nH]c2c(n1)cc(c(c2)C)C
Sc1(nH)c2c(n1)cc(c(c2)C)C
ZINC00239005
ZINC239005
2MERCAPTO56DIMETHYLBENZIMIDAZOLE
3287794
56DIMETHYL13DIHYDROBENZIMIDAZOLE2THIONE
56DIMETHYL1H13BENZODIAZOLE2THIOL
56DIMETHYL1HBENZIMIDAZOLE2THIOL
56DIMETHYL1HBENZO(D)IMIDAZOLE2(3H)THIONE
56DIMETHYL1HBENZOIMIDAZOLE2THIOL
56DIMETHYL23DIHYDRO1HBENZO(D)IMIDAZOLE2THIONE
56DIMETHYL2MERCAPTOBENZIMIDAZOLE
56DIMETHYLBENZIMIDAZOLE2THIOL
CC1=CC2=C(C=C1C)NC(=S)N2
InChI=1SC9H10N2Sc15378(46(5)2)119(12)107h34H12H3(H2101112)
BBL003427
Synonyms: 9H-thioxanthene-3,6-diamine10,10-dioxide
Smiles: Nc1ccc2c(c1)S(=O)(=O)c1c(C2)ccc(c1)N
Nc1ccc2c(c1)S(=O)(=O)c1c(C2)ccc(c1)N
9Hthioxanthene36diamine1010dioxide
9HTHIOXANTHENE37DIAMINE55DIOXIDE
10215255
37DIAMINO10HDIBENZO(BE)THIIN55DIONE
37THIAXANTHENEDIAMINE55DIOXIDE
MFCD00041841
ZINC000000122452
ZINC00122452
ZINC122452
36DIAMINO9H10
1010dioxo9Hthioxanthene36diamine
C1C2=C(C=C(C=C2)N)S(=O)(=O)C3=C1C=CC(=C3)N
InChI=1SC13H12N2O2Sc1410318592411(15)713(9)18(1617)12(8)610h1467H51415H2
BBL003428
Synonyms: [(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetonitrile
Smiles: N#CCSc1n[nH]c(n1)N
N#CCSc1n(nH)c(n1)N
ZINC000002241721
ZINC02241721
ZINC2241721
MFCD00138376
((5AMINO1H124TRIAZOL3YL)SULFANYL)ACETONITRILE
(5AMINO1H(124)TRIAZOL3YLSULFANYL)ACETONITRILE
2((5AMINO1H124TRIAZOL3YL)SULFANYL)ACETONITRILE
2(5AMINO1H124TRIAZOL3YLTHIO)ETHANENITRILE
338751476
AMINOTRIAZOLYLSULFANYLACETONITRILE
C(C#N)SC1=NNC(=N1)N
InChI=1SC4H5N5Sc51210473(6)894h2H2(H36789)
BBL003429
Synonyms: 3-(prop-2-yn-1-ylsulfanyl)-1H-1,2,4-triazol-5-amine
Smiles: C#CCSc1n[nH]c(n1)N
C#CCSc1n(nH)c(n1)N
PROPYNYLSULFANYLTRIAZOLYLAMINE
ZINC17045223
(3(PROPARGYLTHIO)1H124TRIAZOL5YL)AMINE
3(2PROPYNYLSULFANYL)1H124TRIAZOL5YLAMINE
3(PROP2YN1YLSULFANYL)1H124TRIAZOL5AMINE
3(PROP2YNYLTHIO)1H124TRIAZOL5AMINE
3PROP2YNYLSULFANYL1H124TRIAZOL5AMINE
3PROP2YNYLTHIO1H124TRIAZOLE5YLAMINE
5(PROP2YN1YLSULFANYL)2H124TRIAZOL3AMINE
53918448
5PROP2YNYLSULFANYL2H(124)TRIAZOL3YLAMINE
C#CCSC1=NNC(=N1)N
InChI=1SC5H6N4Sc12310574(6)895h1H3H2(H36789)
BBL003430
Synonyms: 2-(2-amino-6-chlorophenyl)ethanol
Smiles: OCCc1c(N)cccc1Cl
OCCc1c(N)cccc1Cl
ZINC00106658
ZINC106658
ETHANOL2(2AMINO6CHLOROPHENYL)
102493685
2(2AMINO6CHLOROPHENYL)ETHAN1OL
2(2AMINO6CHLOROPHENYL)ETHANOL
2(2AMINO6CHLOROPHENYL)ETHYLALCOHOL
2AMINO6CHLOROBENZENEETHANOL
BENZENEETHANOL2AMINO6CHLORO
C1=CC(=C(C(=C1)Cl)CCO)N
InChI=1SC8H10ClNOc972138(10)6(7)4511h1311H4510H2
BBL003431
Synonyms: dibenzo[b,d]furan-2-carbaldehyde
Smiles: O=Cc1ccc2c(c1)c1ccccc1o2
O=Cc1ccc2c(c1)c1ccccc1o2
ZINC000004254218
ZINC04254218
ZINC4254218
BENZO(B)BENZOFURAN2CARBOXALDEHYDE
MFCD00136272
2DIBENZOFURANCARBALDEHYDE
2DIBENZOFURANCARBOXALDEHYDE
5397820
DIBENZO(B)FURAN2CARBALDEHYDE
DIBENZO(BD)FURAN2CARBALDEHYDE
DIBENZO(BD)FURAN2CARBOXALDEHYDE
DIBENZOFURAN2CARBALDEHYDE
DIBENZOFURAN2CARBOXALDEHYDE
C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)C=O
InChI=1SC13H8O2c1489561311(79)10312412(10)1513h18H
BBL003432
Synonyms: 2,4-dichloro-3-methylaniline
Smiles: Clc1ccc(c(c1C)Cl)N
Clc1ccc(c(c1C)Cl)N
MFCD02334760
ZINC000000031315
ZINC00031315
ZINC31315
(24DICHLORO3METHYLPHENYL)AMINE
19853793
24DICHLORO3METHYLANILINE
24DICHLORO3METHYLPHENYLAMINE
24DICHLOROMTOLUIDINE
26DICHLORO3AMINOTOLUENE
BENZENAMINE24DICHLORO3METHYL
CC1=C(C=CC(=C1Cl)N)Cl
InChI=1SC7H7Cl2Nc145(8)236(10)7(4)9h23H10H21H3
BBL003433
Synonyms: 2-[4-(2-phenylpropan-2-yl)phenoxy]ethanamine
Smiles: NCCOc1ccc(cc1)C(c1ccccc1)(C)C
NCCOc1ccc(cc1)C(c1ccccc1)(C)C
ZINC000002876094
ZINC2876094
844881909
(2(4(1METHYL1PHENYLETHYL)PHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(4(1METHYL1PHENYLETHYL)PHENOXY)ETHYLAMINE
2(4(2PHENYLPROPAN2YL)PHENOXY)ETHANAMINE
MFCD05259324
CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN
InChI=1SC17H21NOc117(2146435714)1581016(11915)19131218h311H121318H212H3
BBL003434
Synonyms: 2-(benzyloxy)ethanamine
Smiles: NCCOCc1ccccc1
NCCOCc1ccccc1
ZINC000004287664
ZINC4287664
ETHANAMINE2(PHENYLMETHOXY)
MFCD00235180
2(BENZYLOXY)1ETHANAMINE
2(BENZYLOXY)ETHAN1AMINE
2(BENZYLOXY)ETHANAMINE
2(BENZYLOXY)ETHANEAMINE
2(BENZYLOXY)ETHYLAMINE
2(PHENYLMETHOXY)ETHANAMINE
2(PHENYLMETHOXY)ETHYLAMINE
2BENZYLOXYETHYLAMINE
2PHENYLMETHOXYETHANAMINE
38336048
BENZYLOXYETHANAMINE
BENZYLOXYETHYLAMINE
C1=CC=C(C=C1)COCCN
InChI=1SC9H13NOc10671189421359h15H6810H2
BBL003435
Synonyms: 2-(2-benzylphenoxy)ethanamine
Smiles: NCCOc1ccccc1Cc1ccccc1
NCCOc1ccccc1Cc1ccccc1
ZINC000002545824
ZINC2545824
MFCD00235186
(2(2BENZYLPHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(2BENZYLPHENOXY)1ETHANAMINEHYDROCHLORIDE
2(2BENZYLPHENOXY)ETHANAMINE
2(2BENZYLPHENOXY)ETHYLAMINE
473391309
C1=CC=C(C=C1)CC2=CC=CC=C2OCCN
InChI=1SC15H17NOc1610111715954814(15)12136213713h19H101216H2
BBL003436
Synonyms: 2-(4-amino-2-methoxyphenoxy)-1-(morpholin-4-yl)ethanone
Smiles: COc1cc(N)ccc1OCC(=O)N1CCOCC1
COc1cc(N)ccc1OCC(=O)N1CCOCC1
MFCD07658478
ZINC000004710191
ZINC04710191
ZINC4710191
(3METHOXY4(2MORPHOLIN4YL2OXOETHOXY)PHENYL)AMINEHYDROBROMIDE
2(4AMINO2METHOXYPHENOXY)1(MORPHOLIN4YL)ETHANONE
2(4AMINO2METHOXYPHENOXY)1MORPHOLIN4YLETHAN1ONE
2(4AMINO2METHOXYPHENOXY)1MORPHOLIN4YLETHANONE
3METHOXY4(2(4MORPHOLINYL)2OXOETHOXY)ANILINE
893764788
BENZENAMINE3METHOXY4(2(4MORPHOLINYL)2OXOETHOXY)
COC1=C(C=CC(=C1)N)OCC(=O)N2CCOCC2
InChI=1SC13H18N2O4c11712810(14)2311(12)19913(16)1546187515h238H47914H21H3
BBL003437
Synonyms: 2-(4-amino-2,6-dimethylphenoxy)-1-(pyrrolidin-1-yl)ethanone
Smiles: O=C(N1CCCC1)COc1c(C)cc(cc1C)N
O=C(N1CCCC1)COc1c(C)cc(cc1C)N
ZINC04710056
ZINC4710056
(35DIMETHYL4(2OXO2PYRROLIDIN1YLETHOXY)PHENYL)AMINE
2(4AMINO26DIMETHYLPHENOXY)1(PYRROLIDIN1YL)ETHANONE
2(4AMINO26DIMETHYLPHENOXY)1PYRROLIDIN1YLETHANONE
2(4AMINO26DIMETHYLPHENOXY)1PYRROLIDINYLETHAN1ONE
893766091
BENZENAMINE35DIMETHYL4(2OXO2(1PYRROLIDINYL)ETHOXY)
CC1=CC(=CC(=C1OCC(=O)N2CCCC2)C)N
InChI=1SC14H20N2O2c110712(15)811(2)14(10)18913(17)16534616h78H36915H212H3
BBL003438
Synonyms: 3-(pentafluorophenoxy)propan-1-amine
Smiles: NCCCOc1c(F)c(F)c(c(c1F)F)F
NCCCOc1c(F)c(F)c(c(c1F)F)F
ZINC000004779419
ZINC4779419
MFCD07658084
(3(PENTAFLUOROPHENOXY)PROPYL)AMINEHYDROCHLORIDE
1051368923
3(PENTAFLUOROPHENOXY)PROPAN1AMINE
3(23456pentafluorophenoxy)propan1amine
C(CN)COC1=C(C(=C(C(=C1F)F)F)F)F
InChI=1SC9H8F5NOc1045(11)7(13)9(8(14)6(4)12)1631215h1315H2
BBL003439
Synonyms: N-[2-(5-amino-2-methoxy-4-propylphenoxy)ethyl]acetamide
Smiles: CCCc1cc(OC)c(cc1N)OCCNC(=O)C
CCCc1cc(OC)c(cc1N)OCCNC(=O)C
932924328
MFCD10487704
N(2(3AMINO6METHOXY4PROPYLPHENOXY)ETHYL)ACETAMIDE
N(2(5AMINO2METHOXY4PROPYLPHENOXY)ETHYL)ACETAMIDE
N(2(5AMINO2METHOXY4PROPYLPHENOXY)ETHYL)ACETAMIDEHYDROCHLORIDE
ZINC000020428762
ZINC20428762
CCCC1=CC(=C(C=C1N)OCCNC(=O)C)OC
InChI=1SC14H22N2O3c14511813(183)14(912(11)15)19761610(2)17h89H4715H213H3(H1617)
BBL003440
Synonyms: 2-(1,3-benzodioxol-5-yloxy)-5-(trifluoromethyl)aniline
Smiles: Nc1cc(ccc1Oc1ccc2c(c1)OCO2)C(F)(F)F
Nc1cc(ccc1Oc1ccc2c(c1)OCO2)C(F)(F)F
ZINC000006658086
ZINC06658086
ZINC6658086
(2(13BENZODIOXOL5YLOXY)5(TRIFLUOROMETHYL)PHENYL)AMINEHYDROCHLORIDE
2(13BENZODIOXOL5YLOXY)5(TRIFLUOROMETHYL)ANILINE
2(13BENZODIOXOL5YLOXY)5(TRIFLUOROMETHYL)PHENYLAMINEHYDROCHLORIDE
2(2HBENZO(D)13DIOXOLEN5YLOXY)5(TRIFLUOROMETHYL)PHENYLAMINE
924858708
MFCD08273484
C1OC2=C(O1)C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)N
InChI=1SC14H10F3NO3c1514(1617)81311(10(18)58)219241213(69)2071912h16H718H2
BBL003441
Synonyms: 2,2'-[benzene-1,4-diylbis(oxy)]diethanamine
Smiles: NCCOc1ccc(cc1)OCCN
NCCOc1ccc(cc1)OCCN
ZINC000030834310
ZINC30834310
MFCD12197695
(2(4(2AMINOETHOXY)PHENOXY)ETHYL)AMINEDIHYDROCHLORIDE
1211474359
14BIS(2AMINOETHOXY)BENZENE
2(4(2AMINOETHOXY)PHENOXY)ETHYLAMINE
22(BENZENE14DIYLBIS(OXY))DIETHANAMINE
2(4(2aminoethoxy)phenoxy)ethanamine
C1=CC(=CC=C1OCCN)OCCN
InChI=1SC10H16N2O2c11571391210(439)148612h14H581112H2
BBL003442
Synonyms: methyl(3-amino-4-methoxyphenoxy)acetate
Smiles: COC(=O)COc1ccc(c(c1)N)OC
COC(=O)COc1ccc(c(c1)N)OC
METHYL2(3AMINO4METHOXYPHENOXY)ACETATE
1170855794
METHYL(3AMINO4METHOXYPHENOXY)ACETATE
METHYL(3AMINO4METHOXYPHENOXY)ACETATEHYDROCHLORIDE
MFCD11983395
ZINC000030834225
ZINC30834225
COC1=C(C=C(C=C1)OCC(=O)OC)N
InChI=1SC10H13NO4c1139437(58(9)11)15610(12)142h35H611H212H3
BBL003443
Synonyms: 4-amino-2,6-dimethylphenol
Smiles: Nc1cc(C)c(c(c1)C)O
Nc1cc(C)c(c(c1)C)O
PHENOL4AMINO26DIMETHYL
ZINC000005419587
ZINC05419587
ZINC5419587
15980220
26DIMETHYL4AMINOPHENOL
35DIMETHYL4HYDROXYANILINE
4AMINO26DIMETHYLPHENOL
4AMINO26DIMETHYLPHENOL95
MFCD10039560
CC1=CC(=CC(=C1O)C)N
InChI=1SC8H11NOc1537(9)46(2)8(5)10h3410H9H212H3
BBL003444
Synonyms: 2-(2,5-dichlorophenoxy)ethanamine
Smiles: NCCOc1cc(Cl)ccc1Cl
NCCOc1cc(Cl)ccc1Cl
ZINC4110412
(2(25DICHLOROPHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(25DICHLOROPHENOXY)1ETHANAMINE
2(25DICHLOROPHENOXY)ETHANAMINE
2(25DICHLOROPHENOXY)ETHYLAMINE
50912646
C1=CC(=C(C=C1Cl)OCCN)Cl
InChI=1SC8H9Cl2NOc96127(10)8(56)124311h125H3411H2
BBL003445
Synonyms: 2-chloro-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1cc2c(CCNC(=O)CCl)c[nH]c2cc1
COc1cc2c(CCNC(=O)CCl)c(nH)c2cc1
21424919
2CHLORON(2(5METHOXY1HINDOL3YL)ETHYL)ACETAMIDE
2CHLORON(2(5METHOXY3INDOLYL)ETHYL)ACETAMIDE
2CHLORON(2(5METHOXYINDOL3YL)ETHYL)ACETAMIDE
ACETAMIDE2CHLORON(2(5METHOXY1HINDOL3YL)ETHYL)
ISAMIDE
MFCD00427702
N(1CHLOROACETYL)5METHOXYTRYPTAMINE
NCHLOROACETYL5METHOXYTRYPTAMINE
ZINC000000062298
ZINC00062298
ZINC62298
COC1=CC2=C(C=C1)NC=C2CCNC(=O)CCl
InChI=1SC13H15ClN2O2c11810231211(610)9(81612)451513(17)714h236816H457H21H3(H1517)
BBL003446
Synonyms: 4-amino-N-[3-(morpholin-4-yl)propyl]benzamide
Smiles: O=C(c1ccc(cc1)N)NCCCN1CCOCC1
O=C(c1ccc(cc1)N)NCCCN1CCOCC1
ZINC000019798055
ZINC19798055
(4AMINOPHENYL)N(3MORPHOLIN4YLPROPYL)CARBOXAMIDE
1047620381
4AMINON(3(MORPHOLIN4YL)PROPYL)BENZAMIDE
4AMINON(3MORPHOLIN4YLPROPYL)BENZAMIDE
4AMINON(3MORPHOLIN4YLPROPYL)BENZAMIDEHYDROCHLORIDE
MFCD02063080
C1COCCN1CCCNC(=O)C2=CC=C(C=C2)N
InChI=1SC14H21N3O2c15134212(3513)14(18)16617178101911917h25H161115H2(H1618)
BBL003447
Synonyms: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-2-methylpropan-1-ol
Smiles: OCC(NC1=NS(=O)(=O)c2c1cccc2)(C)C
OCC(NC1=NS(=O)(=O)c2c1cccc2)(C)C
ZINC01461773
ZINC1461773
2((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)2METHYLPROPAN1OL
2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)2METHYLPROPAN1OL
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)2METHYLPROPAN1OL
3((1HYDROXY2METHYLPROPAN2YL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
333352264
CC(C)(CO)NC1=NS(=O)(=O)C2=CC=CC=C21
InChI=1SC11H14N2O3Sc111(2714)1210853469(8)17(1516)1310h3614H7H212H3(H1213)
BBL003448
Synonyms: 2-{2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethoxy}ethanol
Smiles: OCCOCCNC1=NS(=O)(=O)c2c1cccc2
OCCOCCNC1=NS(=O)(=O)c2c1cccc2
ZINC03178047
ZINC3178047
2(2((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)ETHOXY)ETHANOL
2(2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)ETHOXY)ETHANOL
2(2((11DIOXO12BENZOTHIAZOL3YL)AMINO)ETHOXY)ETHANOL
2(2(11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YLAMINO)ETHOXY)ETHANOL
296798362
3((2(2HYDROXYETHOXY)ETHYL)AMINO)12BENZOTHIAZOLE11DIONE
3((2(2HYDROXYETHOXY)ETHYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCOCCO
InChI=1SC11H14N2O4Sc1468177512119312410(9)18(1516)1311h1414H58H2(H1213)
BBL003449
Synonyms: 3-methoxy-1,2-benzothiazole1,1-dioxide
Smiles: COC1=NS(=O)(=O)c2c1cccc2
COC1=NS(=O)(=O)c2c1cccc2
12BENZISOTHIAZOLE3METHOXY11DIOXIDE
18712146
3(METHOXY)12BENZISOTHIAZOLE11DIOXIDE
3METHOXYBENZISOTHIAZOLESSDIOXIDE
3METHOXYBENZO(D)ISOTHIAZOLE11DIOXIDE
SACCHARINOMETHYLETHER
ZINC00175443
ZINC175443
3METHOXY12BENZISOTHIAZOLE11DIOXIDE
3METHOXY12BENZOTHIAZOLE11DIOXIDE
3METHOXY1L(6)2BENZOTHIAZOLE11DIONE
COC1=NS(=O)(=O)C2=CC=CC=C21
InChI=1SC8H7NO3Sc1128642357(6)13(1011)98h25H1H3
BBL003450
Synonyms: 5-chloro-N'-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-methylbenzenesulfonohydrazide
Smiles: Clc1ccc(c(c1)S(=O)(=O)NNC1=NS(=O)(=O)c2c1cccc2)C
Clc1ccc(c(c1)S(=O)(=O)NNC1=NS(=O)(=O)c2c1cccc2)C
ZINC01501295
ZINC1501295
5CHLORON(11DIOXIDO12BENZOTHIAZOL3YL)2METHYLBENZENESULFONOHYDRAZIDE
5CHLORON(11DIOXO12BENZOTHIAZOL3YL)2METHYLBENZENESULFONOHYDRAZIDE
5CHLORON(11DIOXO1L(6)2BENZOTHIAZOL3YL)2METHYLBENZENESULFONOHYDRAZIDE
CC1=C(C=C(C=C1)Cl)S(=O)(=O)NNC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC14H12ClN3O4S2c196710(15)813(9)24(2122)18161411423512(11)23(1920)1714h2818H1H3(H1617)
BBL003451
Synonyms: 1-(1,2-dihydroacenaphthylen-5-yl)-5-oxopyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)c1ccc2c3c1cccc3CC2
OC(=O)C1CC(=O)N(C1)c1ccc2c3c1cccc3CC2
ZINC000000236884
ZINC000000236885
MFCD03719794
1(12DIHYDROACENAPHTHYLEN5YL)5OXOPYRROLIDINE3CARBOXYLICACID
1ACENAPHTHEN5YL5OXOPYRROLIDINE3CARBOXYLICACID
510737505
C1CC2=CC=CC3=C(C=CC1=C23)N4CC(CC4=O)C(=O)O
InChI=1SC17H15NO3c1915812(17(20)21)918(15)147611541021313(14)16(10)11h136712H4589H2(H2021)
BBL003452
Synonyms: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenol
Smiles: Oc1ccccc1NC1=NS(=O)(=O)c2c1cccc2
Oc1ccccc1NC1=NS(=O)(=O)c2c1cccc2
ZINC000000208086
ZINC00208086
ZINC208086
MFCD00763415
2((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PHENOL
2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PHENOL
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENOL
3((2HYDROXYPHENYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
3((2HYDROXYPHENYL)AMINO)BENZO(D)12THIAZOLINE11DIONE
314036118
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC=CC=C3O
InChI=1SC13H10N2O3Sc1611732610(11)14139514812(9)19(1718)1513h1816H(H1415)
BBL003453
Synonyms: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethanol
Smiles: OCCNC1=NS(=O)(=O)c2c1cccc2
OCCNC1=NS(=O)(=O)c2c1cccc2
ZINC02482876
ZINC2482876
2((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)ETHANOL
2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)ETHANOL
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)ETHANOL
3((2HYDROXYETHYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
7677498
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCO
InChI=1SC9H10N2O3Sc1265109731248(7)15(1314)119h1412H56H2(H1011)
BBL003454
Synonyms: 4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-5-methyl-2-(propan-2-yl)phenol
Smiles: Cc1cc(O)c(cc1NC1=NS(=O)(=O)c2c1cccc2)C(C)C
Cc1cc(O)c(cc1NC1=NS(=O)(=O)c2c1cccc2)C(C)C
296790982
3((4HYDROXY5ISOPROPYL2METHYLPHENYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
4((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)2ISOPROPYL5METHYLPHENOL
4((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)5METHYL2(PROPAN2YL)PHENOL
4((11DIOXO12BENZOTHIAZOL3YL)AMINO)5METHYL2PROPAN2YLPHENOL
MFCD01304959
ZINC000000350899
ZINC00350899
ZINC350899
CC1=C(C=C(C(=C1)O)C(C)C)NC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC17H18N2O3Sc110(2)13914(11(3)815(13)20)181712645716(12)23(2122)1917h41020H13H3(H1819)
BBL003455
Synonyms: N'-(1,1-dioxido-1,2-benzothiazol-3-yl)-2,4-dimethylbenzenesulfonohydrazide
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)NNC1=NS(=O)(=O)c2c1cccc2
Cc1ccc(c(c1)C)S(=O)(=O)NNC1=NS(=O)(=O)c2c1cccc2
326903746
MFCD01204249
N(11BIS(OXIDANYLIDENE)12BENZOTHIAZOL3YL)24DIMETHYLBENZENESULFONOHYDRAZIDE
N(11DIKETO12BENZOTHIAZOL3YL)24DIMETHYLBENZENESULFONOHYDRAZIDE
N(11DIOXIDO12BENZISOTHIAZOL3YL)24DIMETHYLBENZENESULFONOHYDRAZIDE
N(11DIOXIDO12BENZOTHIAZOL3YL)24DIMETHYLBENZENESULFONOHYDRAZIDE
N(11DIOXO12BENZOTHIAZOL3YL)24DIMETHYLBENZENESULFONOHYDRAZIDE
N(11DIOXO1L(6)2BENZOTHIAZOL3YL)24DIMETHYLBENZENESULFONOHYDRAZIDE
ZINC000004681147
ZINC4681147
CC1=CC(=C(C=C1)S(=O)(=O)NNC2=NS(=O)(=O)C3=CC=CC=C32)C
InChI=1SC15H15N3O4S2c1107813(11(2)910)24(2122)18161512534614(12)23(1920)1715h3918H12H3(H1617)
BBL003456
Synonyms: 2-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: Nc1nnc(s1)SCCN1C(=O)c2c(S1(=O)=O)cccc2
Nc1nnc(s1)SCCN1C(=O)c2c(S1(=O)=O)cccc2
ZINC000002867172
ZINC02867172
ZINC2867172
2(2((5AMINO134THIADIAZOL2YL)SULFANYL)ETHYL)11DIOXO12BENZOTHIAZOL3ONE
2(2((5AMINO134THIADIAZOL2YL)SULFANYL)ETHYL)12BENZOTHIAZOL3(2H)ONE11DIOXIDE
2(2((5AMINO134THIADIAZOL2YL)SULFANYL)ETHYL)1L(6)2BENZOTHIAZOLE113TRIONE
2(2((5AMINO134THIADIAZOL2YL)THIO)ETHYL)12BENZISOTHIAZOL3(2H)ONE11DIOXIDE
823831078
MFCD05999019
C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCSC3=NN=C(S3)N
InChI=1SC11H10N4O3S3c1210131411(2010)1965159(16)731248(7)21(1517)18h14H56H2(H21213)
BBL003457
Synonyms: 5-hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
Smiles: O=Cc1c(C)nn(c1O)c1ccccc1
O=Cc1c(C)nn(c1O)c1ccccc1
5hydroxy3methyl1phenyl1Hpyrazole4carbaldehyde
60484299
MFCD00448479
ZINC000100142516
BBL003458
Synonyms: 6-amino-3,4-dihydroquinolin-2(1H)-one
Smiles: O=C1CCc2c(N1)ccc(c2)N
O=C1CCc2c(N1)ccc(c2)N
ZINC04342847
ZINC4342847
6AMINO134TRIHYDROQUINOLIN2ONE
2(1H)QUINOLINONE6AMINO34DIHYDRO
22246135
6AMINO34DIHYDRO1HQUINOLIN2ONE
6AMINO34DIHYDRO1HQUINOLINE2ONE
6AMINO34DIHYDRO2(1)QUINALINONE
6AMINO34DIHYDRO2(1H)QUINALINONE
6AMINO34DIHYDRO2(1H)QUINOLINONE
6AMINO34DIHYDROQUINOLIN2(1H)ONE
6AMINO34DIHYDROQUINOLIN2ONE
6AZANYL34DIHYDRO1HQUINOLIN2ONE
C1CC(=O)NC2=C1C=C(C=C2)N
InChI=1SC9H10N2Oc1072386(57)149(12)118h235H1410H2(H1112)
BBL003459
Synonyms: 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylicacid
Smiles: OC(=O)c1c[nH]c(=O)[nH]1
OC(=O)c1c(nH)c(=O)(nH)1
OXODIHYDROIMIDAZOLECARBOXYLICACID
ZINC000006667673
ZINC6667673
2HYDROXY1HIMIDAZOLE4CARBOXYLICACID
GLYOXALONE4CARBOXYLICACID
MFCD01547735
1HIMIDAZOLE4CARBOXYLICACID23DIHYDRO2OXO
2HYDROXYIMIDAZOLE4CARBOXYLICACID
2OXIDANYLIDENE13DIHYDROIMIDAZOLE4CARBOXYLICACID
2OXO13DIHYDROIMIDAZOLE4CARBOXYLICACID
2OXO23DIHYDRO1HIMIDAZOLE4CARBOXYLICACID
2OXO4IMIDAZOLINE4CARBOXYLICACID
39828472
C1=C(NC(=O)N1)C(=O)O
InChI=1SC4H4N2O3c73(8)2154(9)62h1H(H78)(H2569)
BBL003460
Synonyms: ethyl(4-amino-2-methoxyphenyl)carbamate
Smiles: CCOC(=O)Nc1ccc(cc1OC)N
CCOC(=O)Nc1ccc(cc1OC)N
ETHYL(4AMINO2METHOXYPHENYL)CARBAMATE
ETHYL(4AMINO2METHOXYPHENYL)CARBAMATEHYDROCHLORIDE
ETHYL4AMINO2METHOXYPHENYLCARBAMATE
ETHYLN(4AMINO2METHOXYPHENYL)CARBAMATE
MFCD07021991
N(4AMINO2METHOXYPHENYL)ETHOXYCARBOXAMIDE
ZINC000004708878
ZINC04708878
ZINC4708878
(4AMINO2METHYLOXYPHENYL)CARBAMICACIDETHYLESTER
1051368729
CCOC(=O)NC1=C(C=C(C=C1)N)OC
InChI=1SC10H14N2O3c131510(13)128547(11)69(8)142h46H311H212H3(H1213)
BBL003461
Synonyms: 3-chlorobenzohydrazide
Smiles: NNC(=O)c1cccc(c1)Cl
NNC(=O)c1cccc(c1)Cl
ZINC00080753
ZINC80753
1673478
3CHLOROBENZENECARBOHYDRAZIDE
3CHLOROBENZHYDRAZIDE
3CHLOROBENZOHYDRAZIDE
3CHLOROBENZOICACIDHYDRAZIDE
3CHLOROBENZOICHYDRAZIDE
3CHLOROBENZOYLHYDRAZINE
BENZOICACID3CHLOROHYDRAZIDE
BENZOYLHYDRAZINEMCHLORO
C1=CC(=CC(=C1)Cl)C(=O)NN
InChI=1SC7H7ClN2Oc863125(46)7(11)109h14H9H2(H1011)
BBL003462
Synonyms: (2E)-3-(4-bromophenyl)-1-phenylprop-2-en-1-one
Smiles: Brc1ccc(cc1)/C=C/C(=O)c1ccccc1
Brc1ccc(cc1)C=CC(=O)c1ccccc1
ZINC04087479
ZINC4087479
(2E)3(4BROMOPHENYL)1PHENYL2PROPEN1ONE
(2E)3(4BROMOPHENYL)1PHENYLPROP2EN1ONE
(E)3(4BROMOPHENYL)1PHENYL2PROPEN1ONE
(E)3(4BROMOPHENYL)1PHENYLPROP2EN1ONE
(E)4BROMOCHALCONE
1(4BROMOPHENYL)3PHENYLPROPENONE
1774669
2PROPEN1ONE3(4BROMOPHENYL)1PHENYL
2PROPEN1ONE3(4BROMOPHENYL)1PHENYL(2E)
2PROPEN1ONE3(4BROMOPHENYL)1PHENYL(E)
3(4BROMOPHENYL)1PHENYL2PROPEN1ONE
3(4BROMOPHENYL)1PHENYLPROP2EN1ONE
4BROMOCHALCONE
C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Br
InChI=1SC15H11BrOc16149612(71014)81115(17)134213513h111Hb118+
BBL003463
Synonyms: 5-chloro-1-(3-chlorophenyl)-3-methyl-1H-pyrazole-4-carbaldehyde
Smiles: O=Cc1c(C)nn(c1Cl)c1cccc(c1)Cl
O=Cc1c(C)nn(c1Cl)c1cccc(c1)Cl
ZINC000003246477
ZINC03246477
ZINC3246477
5CHLORO1(3CHLOROPHENYL)3METHYL1HPYRAZOLE4CARBALDEHYDE
5CHLORO1(3CHLOROPHENYL)3METHYLPYRAZOLE4CARBALDEHYDE
77509923
MFCD03980997
CC1=NN(C(=C1C=O)Cl)C2=CC(=CC=C2)Cl
InChI=1SC11H8Cl2N2Oc1710(616)11(13)15(147)94238(12)59h26H1H3
BBL003464
Synonyms: 5-methyl-10,11-dihydro-5H-dibenzo[b,f]azepine-2-carbaldehyde
Smiles: O=Cc1ccc2c(c1)CCc1c(N2C)cccc1
O=Cc1ccc2c(c1)CCc1c(N2C)cccc1
5methyl1011dihydro5Hdibenzo(bf)azepine2carbaldehyde
5METHYL10H11HDIBENZO(BF)AZAPERHYDROEPINE2CARBALDEHYDE
6487678
ZINC000004343253
ZINC04343253
ZINC4343253
11METHYL56DIHYDROBENZO(B)(1)BENZAZEPINE3CARBALDEHYDE
MFCD06619352
CN1C2=C(CCC3=CC=CC=C31)C=C(C=C2)C=O
InChI=1SC16H15NOc11715532413(15)78141012(1118)6916(14)17h26911H78H21H3
BBL003465
Synonyms: 6-amino[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: NC(=O)c1cc2cc3OCOc3cc2nc1N
NC(=O)c1cc2cc3OCOc3cc2nc1N
ZINC000019015010
ZINC19015010
6AMINO2H(13)DIOXOLO(45G)QUINOLINE7CARBOXAMIDE
6AMINO2H13DIOXOLANO(45G)QUINOLINE7CARBOXAMIDE
(13)DIOXOLO(45G)QUINOLINE7CARBOXAMIDE6AMINO
55149478
67METHYLENEDIOXY2AMINOQUINOLINE3CARBOXAMIDE
6AMINO(13)DIOXOLO(45G)QUINOLINE7CARBOXAMIDE
MFCD07801056
C1OC2=CC3=CC(=C(N=C3C=C2O1)N)C(=O)N
InChI=1SC11H9N3O3c12106(11(13)15)15289(174168)37(5)1410h13H4H2(H21214)(H21315)
BBL003466
Synonyms: 4-amino-N-(pyridin-2-yl)benzamide
Smiles: Nc1ccc(cc1)C(=O)Nc1ccccn1
Nc1ccc(cc1)C(=O)Nc1ccccn1
PYRIDINE2(PAMINOBENZAMIDO)
ZINC000000794585
ZINC00794585
ZINC794585
MFCD00454678
(4AMINOPHENYL)N(2PYRIDYL)CARBOXAMIDE
2(PAMINOBENZAMIDO)PYRIDINE
4AMINOBENZAMIDOPYRIDINE
4AMINON(2PYRIDINYL)BENZAMIDE
4AMINON(2PYRIDYL)BENZAMIDE
4AMINON(PYRIDIN2YL)BENZAMIDE
4AMINONPYRIDIN2YLBENZAMIDE
4AMINONPYRIDINE2YLBENZAMIDE
7467427
BENZAMIDE4AMINON2PYRIDINYL
BENZAMIDE4AMINON2PYRIDINYL(9CI)
BENZAMIDEPAMINON2PYRIDINYL
C1=CC=NC(=C1)NC(=O)C2=CC=C(C=C2)N
InChI=1SC12H11N3Oc1310649(5710)12(16)151131281411h18H13H2(H141516)
BBL003467
Synonyms: 2-(4-butoxyphenoxy)ethanamine
Smiles: CCCCOc1ccc(cc1)OCCN
CCCCOc1ccc(cc1)OCCN
MFCD06654478
ZINC000004072685
ZINC4072685
(2(4BUTOXYPHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(4BUTOXYPHENOXY)ETHANAMINE
2(4BUTOXYPHENOXY)ETHYLAMINE
893618525
CCCCOC1=CC=C(C=C1)OCCN
InChI=1SC12H19NO2c123914114612(7511)1510813h47H2381013H21H3
BBL003468
Synonyms: 2-(2,3-dihydro-1H-inden-5-yloxy)ethanamine
Smiles: NCCOc1ccc2c(c1)CCC2
NCCOc1ccc2c(c1)CCC2
ZINC9245981
(2(23DIHYDRO1HINDEN5YLOXY)ETHYL)AMINEHYDROCHLORIDE
2((23DIHYDRO1HINDEN5YL)OXY)ETHANAMINE
2(23DIHYDRO1HINDEN5YLOXY)ETHANAMINE
2(INDAN5YLOXY)ETHYLAMINE
2INDAN5YLOXYETHYLAMINE
72955841
C1CC2=C(C1)C=C(C=C2)OCCN
InChI=1SC11H15NOc1267131154921310(9)811h458H136712H2
BBL003469
Synonyms: N-{2-[(2-methyl-1,2,3,4-tetrahydroquinolin-8-yl)oxy]ethyl}acetamide
Smiles: CC1CCc2c(N1)c(OCCNC(=O)C)ccc2
CC1CCc2c(N1)c(OCCNC(=O)C)ccc2
N(2((2methyl1234tetrahydroquinolin8yl)oxy)ethyl)acetamide
ZINC000012417860
ZINC000012417862
MFCD09763882
931588113
CC1CCC2=C(N1)C(=CC=C2)OCCNC(=O)C
InChI=1SC14H20N2O2c110671243513(14(12)1610)18981511(2)17h351016H69H212H3(H1517)
BBL003470
Synonyms: N-[2-(1,2,3,4-tetrahydroquinolin-8-yloxy)ethyl]acetamide
Smiles: CC(=O)NCCOc1cccc2c1NCCC2
CC(=O)NCCOc1cccc2c1NCCC2
N(2(1234tetrahydroquinolin8yloxy)ethyl)acetamide
ZINC000012364292
ZINC12364292
MFCD09763880
931586480
CC(=O)NCCOC1=CC=CC2=C1NCCC2
InChI=1SC13H18N2O2c110(16)14891712624115371513(11)12h24615H3579H21H3(H1416)
BBL003471
Synonyms: 3-(3-aminophenyl)-5-methylimidazolidine-2,4-dione
Smiles: Nc1cccc(c1)N1C(=O)NC(C1=O)C
Nc1cccc(c1)N1C(=O)NC(C1=O)C
ZINC000030834344
ZINC000030834347
MFCD12151977
1214061967
3(3AMINOPHENYL)5METHYL13DIAZOLIDINE24DIONE
3(3AMINOPHENYL)5METHYLIMIDAZOLIDINE24DIONE
CC1C(=O)N(C(=O)N1)C2=CC(=CC=C2)N
InChI=1SC10H11N3O2c169(14)13(10(15)126)84237(11)58h26H11H21H3(H1215)
BBL003472
Synonyms: 5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carbaldehyde
Smiles: O=Cc1c(C)nn(c1O)c1ccc(cc1)C
O=Cc1c(C)nn(c1O)c1ccc(cc1)C
5hydroxy3methyl1(4methylphenyl)1Hpyrazole4carbaldehyde
BBL003473
Synonyms: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]ethanol
Smiles: OCCN(C1=NS(=O)(=O)c2c1cccc2)C
OCCN(C1=NS(=O)(=O)c2c1cccc2)C
ZINC000001211873
ZINC01211873
ZINC1211873
2((11DIOXIDO12BENZISOTHIAZOL3YL)(METHYL)AMINO)ETHANOL
2((11DIOXIDO12BENZOTHIAZOL3YL)(METHYL)AMINO)ETHANOL
2((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)ETHANOL
296798351
3((2HYDROXYETHYL)(METHYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
MFCD00490410
CN(CCO)C1=NS(=O)(=O)C2=CC=CC=C21
InChI=1SC10H12N2O3Sc112(6713)10842359(8)16(1415)1110h2513H67H21H3
BBL003474
Synonyms: 3-(1-methylhydrazinyl)-1,2-benzothiazole1,1-dioxide
Smiles: CN(C1=NS(=O)(=O)c2c1cccc2)N
CN(C1=NS(=O)(=O)c2c1cccc2)N
3(1METHYLHYDRAZIN1YL)1L(6)2BENZOTHIAZOLE11DIONE
3(1METHYLHYDRAZINO)12BENZISOTHIAZOLE11DIOXIDE
3(1METHYLHYDRAZINYL)12BENZOTHIAZOLE11DIOXIDE
3(AMINOMETHYLAMINO)BENZO(D)12THIAZOLE11DIONE
303064940
N(11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YL)NMETHYLHYDRAZINE
ZINC00039695
ZINC39695
1(11DIOXO12BENZOTHIAZOL3YL)1METHYLHYDRAZINE
CN(C1=NS(=O)(=O)C2=CC=CC=C21)N
InChI=1SC8H9N3O2Sc111(9)8642357(6)14(1213)108h25H9H21H3
BBL003475
Synonyms: 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetohydrazide
Smiles: NNC(=O)Cc1n[nH]c(=O)c2c1cccc2
NNC(=O)Cc1n(nH)c(=O)c2c1cccc2
ZINC17322733
1PHTHALAZINEACETICACID34DIHYDRO4OXOHYDRAZIDE
2(4OXO34DIHYDROPHTHALAZIN1YL)ACETOHYDRAZIDE
2(4OXO3HPHTHALAZIN1YL)ACETOHYDRAZIDE
25947186
4(METHYL)2HYDROPHTHALAZIN1ONE
C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NN
InChI=1SC10H10N4O2c11129(15)58631247(6)10(16)14138h14H511H2(H1215)(H1416)
BBL003476
Synonyms: N-(1,1-dioxido-1,2-benzothiazol-3-yl)propane-1,3-diamine
Smiles: NCCCNC1=NS(=O)(=O)c2c1cccc2
NCCCNC1=NS(=O)(=O)c2c1cccc2
ZINC000005685306
ZINC5685306
3((3AMINOPROPYL)AMINO)1L(6)2BENZOTHIAZOLE11DIONE
345972227
MFCD01442101
N(11DIOXIDO12BENZISOTHIAZOL3YL)PROPANE13DIAMINE
N(11DIOXIDO12BENZOTHIAZOL3YL)PROPANE13DIAMINE
N(11DIOXO12BENZOTHIAZOL3YL)PROPANE13DIAMINE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCN
InChI=1SC10H13N3O2Sc116371210841259(8)16(1415)1310h1245H36711H2(H1213)
BBL003477
Synonyms: 3-(2,2,2-trifluoroethoxy)benzaldehyde
Smiles: O=Cc1cccc(c1)OCC(F)(F)F
O=Cc1cccc(c1)OCC(F)(F)F
ZINC000012354428
ZINC12354428
BENZALDEHYDE3(222TRIFLUOROETHOXY)
155908580
3(222TRIFLUOROETHOXY)BENZALDEHYDE
MFCD07432793
C1=CC(=CC(=C1)OCC(F)(F)F)C=O
InChI=1SC9H7F3O2c109(1112)61483127(48)513h15H6H2
BBL003478
Synonyms: 8-chloro-2-hydroxyquinoline-4-carboxylicacid
Smiles: Oc1cc(C(=O)O)c2c(n1)c(Cl)ccc2
Oc1cc(C(=O)O)c2c(n1)c(Cl)ccc2
ZINC8691839
30333563
4QUINOLINECARBOXYLICACID8CHLORO12DIHYDRO2OXO
8CHLORO2HYDROXYQUINOLINE4CARBOXYLICACID
8CHLORO2OXO12DIHYDROQUINOLINE4CARBOXYLICACID
8CHLORO2OXO1HQUINOLINE4CARBOXYLICACID
C1=CC2=C(C(=C1)Cl)NC(=O)C=C2C(=O)O
InChI=1SC10H6ClNO3c11731256(10(14)15)48(13)129(5)7h14H(H1213)(H1415)
BBL003479
Synonyms: 2-acetyl-5,5-dimethylcyclohexane-1,3-dione
Smiles: O=C1CC(C)(C)CC(=O)C1C(=O)C
O=C1CC(C)(C)CC(=O)C1C(=O)C
ZINC000100010773
ZINC100010773
CYCLOHEXANE13DIONE2ACETYL55DIMETHYL
1755153
1ACETYL44DIMETHYL26DIOXOCYCLOHEXANE
2ACETHYLDIMEDONE
2ACETYL55DIMETHYL13CYCLOHEXANEDIONE
2ACETYL55DIMETHYLCYCLOHEXANE13DIONE
2ACETYLDIMEDONE
MFCD00467663
CC(=O)C1C(=O)CC(CC1=O)(C)C
InChI=1SC10H14O3c16(11)97(12)410(23)58(9)13h9H45H213H3
BBL003480
Synonyms: 4-(5-amino-3-tert-butyl-1H-pyrazol-1-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1nc(cc1N)C(C)(C)C
OC(=O)c1ccc(cc1)n1nc(cc1N)C(C)(C)C
ZINC4290826
4(5AMINO3(TERTBUTYL)PYRAZOLYL)BENZOICACID
4(5AMINO3TERTBUTYL1HPYRAZOL1YL)BENZOICACID
4(5AMINO3TERTBUTYLPYRAZOL1YL)BENZOICACID
869663569
CC(C)(C)C1=NN(C(=C1)N)C2=CC=C(C=C2)C(=O)O
InChI=1SC14H17N3O2c114(23)11812(15)17(1611)10649(5710)13(18)19h48H15H213H3(H1819)
BBL003481
Synonyms: 5-[2-(trifluoromethyl)phenyl]furan-2-carboxylicacid
Smiles: OC(=O)c1ccc(o1)c1ccccc1C(F)(F)F
OC(=O)c1ccc(o1)c1ccccc1C(F)(F)F
ZINC000000349812
ZINC349812
MFCD02602847
5(2(TRIFLUOROMETHYL)PHENYL)2FUROICACID
5(2(TRIFLUOROMETHYL)PHENYL)FURAN2CARBOXYLICACID
5(2PHENYL)2FUROIC
5(2TRIFLUOROMETHYLPHENYL)FURAN2CARBOXYLICACID
92973245
C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)O)C(F)(F)F
InChI=1SC12H7F3O3c1312(1415)842137(8)95610(189)11(16)17h16H(H1617)
BBL003482
Synonyms: 2-chloro-1-(3-methyl-1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethanone
Smiles: ClCC(=O)n1c2ccccc2c2c1CCC(C2)C
ClCC(=O)n1c2ccccc2c2c1CCC(C2)C
2chloro1(3methyl1234tetrahydro9Hcarbazol9yl)ethanone
672936195
MFCD03904144
ZINC000000543919
ZINC000000543920
2chloro1(3methyl1234tetrahydrocarbazol9yl)ethanone
CC1CCC2=C(C1)C3=CC=CC=C3N2C(=O)CCl
InChI=1SC15H16ClNOc110671412(810)11423513(11)17(14)15(18)916h2510H69H21H3
BBL003483
Synonyms: 1,2,3,4-tetrahydro-9H-carbazol-9-ylaceticacid
Smiles: OC(=O)Cn1c2ccccc2c2c1CCCC2
OC(=O)Cn1c2ccccc2c2c1CCCC2
1234tetrahydro9Hcarbazol9ylaceticacid
2(34DIHYDRO1HCARBAZOL9(2H)YL)ACETICACID
ZINC808661
BBL003484
Synonyms: 4-[2-(morpholin-4-yl)-1,3-thiazol-4-yl]aniline
Smiles: Nc1ccc(cc1)c1csc(n1)N1CCOCC1
Nc1ccc(cc1)c1csc(n1)N1CCOCC1
ZINC03885544
ZINC3885544
(4(2MORPHOLIN4YL13THIAZOL4YL)PHENYL)AMINE
4(2(4MORPHOLINYL)13THIAZOL4YL)ANILINE
4(2(MORPHOLIN4YL)13THIAZOL4YL)ANILINE
4(2MORPHOLIN4YL13THIAZOL4YL)ANILINE
4(2MORPHOLIN4YL13THIAZOL4YL)PHENYLAMINE
4(2MORPHOLIN4YLTHIAZOL4YL)PHENYLAMINE
883545593
C1COCCN1C2=NC(=CS2)C3=CC=C(C=C3)N
InChI=1SC13H15N3OSc14113110(2411)1291813(1512)1657178616h149H5814H2
BBL003485
Synonyms: 3-[2-(propan-2-yl)-1H-imidazol-1-yl]propan-1-amine
Smiles: NCCCn1ccnc1C(C)C
NCCCn1ccnc1C(C)C
ZINC6677618
3(2ISOPROPYL1HIMIDAZOL1YL)PROPAN1AMINE
3(2ISOPROPYLIMIDAZOL1YL)PROPAN1AMINE
3(2ISOPROPYLIMIDAZOL1YL)PROPYLAMINE
1HIMIDAZOLE1PROPANAMINE2
3(2(METHYLETHYL)IMIDAZOLYL)PROPYLAMINE
3(2(PROPAN2YL)1HIMIDAZOL1YL)PROPAN1AMINE
3(2PROPAN2YLIMIDAZOL1YL)PROPAN1AMINE
733756666
CC(C)C1=NC=CN1CCCN
InChI=1SC9H17N3c18(2)9115712(9)63410h578H34610H212H3
BBL003486
Synonyms: 5-nitro-1H-1,2,4-triazole-3-carboxylicacid
Smiles: [O-][N+](=O)c1[nH]nc(n1)C(=O)O
(O)(N+)(=O)c1(nH)nc(n1)C(=O)O
21732990
3NITRO1H124TRIAZOLE5CARBOXYLICACID
5NITRO1H(124)TRIAZOLE3CARBOXYLICACID
5NITRO1H124TRIAZOLE3CARBOXYLICACID
ZINC4476433
C1(=NC(=NN1)(N+)(=O)(O))C(=O)O
InChI=1SC3H2N4O4c82(9)143(651)7(10)11h(H89)(H456)
BBL003487
Synonyms: 5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-amine
Smiles: COc1cc(cc(c1OC)OC)c1nnc(o1)N
COc1cc(cc(c1OC)OC)c1nnc(o1)N
MFCD01710626
ZINC000019266883
ZINC19266883
134OXADIAZOL2AMINE5(345TRIMETHOXYPHENYL)
1673434
5(345TRIMETHOXYPHENYL)(134)OXADIAZOL2YLAMINE
5(345TRIMETHOXYPHENYL)134OXADIAZOL2AMINE
5(345TRIMETHOXYPHENYL)134OXADIAZOL2YLAMINE
5(345TRIMETHOXYPHENYL)134OXADIAZOLE2YLAMINE
COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)N
InChI=1SC11H13N3O4c115746(10131411(12)1810)58(162)9(7)173h45H13H3(H21214)
BBL003488
Synonyms: 4,6-dimethoxybenzene-1,3-disulfonyldichloride
Smiles: COc1cc(OC)c(cc1S(=O)(=O)Cl)S(=O)(=O)Cl
COc1cc(OC)c(cc1S(=O)(=O)Cl)S(=O)(=O)Cl
13BENZENEDISULFONYLDICHLORIDE46DIMETHOXY
24DIMETHOXYBENZENE15BIS(SULFONICACIDCHLORIDE)
46DIMETHOXYBENZENE13DISULFONYLDICHLORIDE
80585406
CHLORO(5(CHLOROSULFONYL)24DIMETHOXYPHENYL)SULFONE
MFCD09033910
ZINC000100274187
ZINC100274187
46dimethoxybenzene13disulfonylchloride
COC1=CC(=C(C=C1S(=O)(=O)Cl)S(=O)(=O)Cl)OC
InChI=1SC8H8Cl2O6S2c115536(162)8(18(1013)14)47(5)17(911)12h34H12H3
BBL003489
Synonyms: 4-amino-6-chlorobenzene-1,3-disulfonamide
Smiles: Nc1cc(Cl)c(cc1S(=O)(=O)N)S(=O)(=O)N
Nc1cc(Cl)c(cc1S(=O)(=O)N)S(=O)(=O)N
ZINC000001530783
ZINC01530783
ZINC1530783
13DISULFONAMIDE4AMINO6CHLOROBENZENE
14AMINO6CHLORO
1AMINO3CHLORO46BENZENEDISULFONAMIDE
24DISULFAMOYL5CHLOROANILINE
2AMINO4CHLORO5SULFAMOYLBENZENESULFONAMIDE
3CHLORO46DISULFAMOYLANILINE
3CHLOROANILINE46DISULFONAMIDE
4AMINO6CHLORO13BENZENDISULFONAMIDE
4AMINO6CHLORO13BENZENEDISULFONAMIDE
4AMINO6CHLOROBENZENE13DISULFONAMIDE
4AMINO6CHLOROBENZENE13DISULFONICACIDDIAMIDE
4AMINO6CHLOROBENZENE13DISULPHONAMIDE
4AMINO6CHLOROMBENZENEDISULFONAMIDE
4AZANYL6CHLORANYLBENZENE13DISULFONAMIDE
5(3)CHLOROANILINE24(46)DISULFONAMIDE
5CHLORO24BIS(SULFONAMIDE)ANILINE
5CHLORO24DISULFAMOYLANILINE
5CHLORO24DISULFAMYLANILINE
6AMINO4CHLOROBENZENE13DISULFONAMIDE
AROMATICHETEROAROMATICSULFONAMIDE12
MBENZENEDISULFONAMIDE4AMINO6CHLORO
MBENZENEDISULFONAMIDE4AMINO6CHLORO(8CI)
MCHLOROANILINE46DISULFONAMIDE
MFCD00007933
121302
13BENZENEDISULFONAMIDE4AMINO6CHLORO
CHLORAMINOPHENAMIDE
CHLOROAMINOPHENAMIDE
C1=C(C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)N)N
InChI=1SC6H8ClN3O4S2c7314(8)6(16(1013)14)25(3)15(911)12h12H8H2(H291112)(H2101314)
BBL003490
Synonyms: 4-(benzyloxy)benzohydrazide
Smiles: NNC(=O)c1ccc(cc1)OCc1ccccc1
NNC(=O)c1ccc(cc1)OCc1ccccc1
ZINC000001452228
ZINC01452228
ZINC1452228
MFCD00564772
(4BENZYLOXYBENZOYL)HYDRAZINE
128958656
4(BENZYLOXY)BENZHYDRAZIDE
4(BENZYLOXY)BENZOHYDRAZIDE
4(PHENYLMETHOXY)BENZENECARBOHYDRAZIDE
4BENZYLOXYBENZHYDRAZIDE
4BENZYLOXYBENZOHYDRAZIDE
4BENZYLOXYBENZOICACIDHYDRAZIDE
4PHENYLMETHOXYBENZOHYDRAZIDE
BENZOICACID4(PHENYLMETHOXY)HYDRAZIDE
C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NN
InChI=1SC14H14N2O2c151614(17)126813(9712)1810114213511h19H1015H2(H1617)
BBL003491
Synonyms: (4-aminophenyl)(2-methylpiperidin-1-yl)methanone
Smiles: Nc1ccc(cc1)C(=O)N1CCCCC1C
Nc1ccc(cc1)C(=O)N1CCCCC1C
4((2METHYLPIPERIDIN1YL)CARBONYL)ANILINE
METHANONE(4AMINOPHENYL)(2METHYL1PIPERIDINYL)
(4((2METHYLPIPERIDIN1YL)CARBONYL)PHENYL)AMINE
(4AMINOPHENYL)(2METHYLPIPERIDIN1YL)METHANONE
4(2METHYLPIPERIDINE1CARBONYL)ANILINE
436095317
4AMINOPHENYL2METHYLPIPERIDYLKETONE
CC1CCCCN1C(=O)C2=CC=C(C=C2)N
InChI=1SC13H18N2Oc110423915(10)13(16)115712(14)8611h5810H24914H21H3
BBL003492
Synonyms: 4-(4H-1,2,4-triazol-4-yl)phenol
Smiles: Oc1ccc(cc1)n1cnnc1
Oc1ccc(cc1)n1cnnc1
PHENOL4(4H124TRIAZOL4YL)
ZINC14988509
4(4H124TRIAZOL4YL)PHENOL
4(4H124TRIAZOLE4YL)PHENOL
4(4HYDROXYPHENYL)124TRIAZOLE
4(124)TRIAZOL4YLPHENOL
4(124TRIAZOL4YL)PHENOL
98581863
C1=CC(=CC=C1N2C=NN=C2)O
InChI=1SC8H7N3Oc128317(248)115910611h1612H
BBL003493
Synonyms: 2-(quinolin-8-yloxy)ethanamine
Smiles: NCCOc1cccc2c1nccc2
NCCOc1cccc2c1nccc2
ZINC000016623025
ZINC16623025
2(QUINOLIN8YLOXY)ETHANAMINE
16237324
2(8QUINOLYLOXY)ETHYLAMINE
MFCD10487694
2quinolin8yloxyethanamine
C1=CC2=C(C(=C1)OCCN)N=CC=C2
InChI=1SC11H12N2Oc1268141051394271311(9)10h157H6812H2
BBL003494
Synonyms: 1-(4-bromophenyl)-3-methyl-1H-pyrazol-5-amine
Smiles: Brc1ccc(cc1)n1nc(cc1N)C
Brc1ccc(cc1)n1nc(cc1N)C
1(4BROMOPHENYL)3METHYL1HPYRAZOL5AMINE
2(4BROMOPHENYL)5METHYLPYRAZOL3AMINE
82447618
ZINC00065243
ZINC65243
CC1=NN(C(=C1)N)C2=CC=C(C=C2)Br
InChI=1SC10H10BrN3c17610(12)14(137)9428(11)359h26H12H21H3
BBL003495
Synonyms: 5-(2-methoxy-4-nitrophenyl)furan-2-carbaldehyde
Smiles: COc1cc(ccc1c1ccc(o1)C=O)[N+](=O)[O-]
COc1cc(ccc1c1ccc(o1)C=O)(N+)(=O)(O)
299202827
2FURANCARBOXALDEHYDE5(2METHOXY4NITROPHENYL)
5(2METHOXY4NITROPHENYL)2FURALDEHYDE
5(2METHOXY4NITROPHENYL)2FURALDEHYDE95
5(2METHOXY4NITROPHENYL)FURAN2CARBALDEHYDE
MFCD00613051
ZINC000000058458
ZINC00058458
ZINC58458
COC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=O
InChI=1SC12H9NO5c1171268(13(15)16)2410(12)11539(714)1811h27H1H3
BBL003496
Synonyms: 3-(5,6-dimethyl-1,3-benzoxazol-2-yl)aniline
Smiles: Nc1cccc(c1)c1oc2c(n1)cc(c(c2)C)C
Nc1cccc(c1)c1oc2c(n1)cc(c(c2)C)C
ZINC000000122990
ZINC00122990
ZINC122990
3(56DIMETHYLBENZOOXAZOL2YL)PHENYLAMINE
3(56DIMETHYLBENZOXAZOL2YL)PHENYLAMINE
293737732
3(56DIMETHYL13BENZOXAZOL2YL)ANILINE
3(56DIMETHYLBENZO(D)OXAZOL2YL)ANILINE
BENZENAMINE3(56DIMETHYL2BENZOXAZOLYL)
MFCD00442420
CC1=CC2=C(C=C1C)OC(=N2)C3=CC(=CC=C3)N
InChI=1SC15H14N2Oc1961314(710(9)2)1815(1713)1143512(16)811h38H16H212H3
BBL003497
Synonyms: 3-[4-(pentyloxy)phenyl]-1H-pyrazole-5-carboxylicacid
Smiles: CCCCCOc1ccc(cc1)c1cc([nH]n1)C(=O)O
CCCCCOc1ccc(cc1)c1cc((nH)n1)C(=O)O
ZINC38478099
5(4(PENTYLOXY)PHENYL)2HPYRAZOLE3CARBOXYLICACID
1229304704
3(4(PENTYLOXY)PHENYL)1HPYRAZOLE5CARBOXYLICACID
3(4PENTYLOXYPHENYL)PYRAZOLE5CARBOXYLICACID
3(4pentoxyphenyl)1Hpyrazole5carboxylicacid
CCCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)O
InChI=1SC15H18N2O3c1234920127511(6812)131014(15(18)19)171613h5810H249H21H3(H1617)(H1819)
BBL003498
Synonyms: 4,7-dibromo-2,1,3-benzothiadiazole
Smiles: Brc1ccc(c2c1nsn2)Br
Brc1ccc(c2c1nsn2)Br
ZINC00330012
ZINC330012
15155416
47BIS(BROMANYL)213BENZOTHIADIAZOLE
47DIBROMO213BENZOTHIADIAZOLE
47DIBROMO213BENZOTHIDIAZOLE
47DIBROMOBENZO(125)THIADIAZOLE
47DIBROMOBENZO(C)(125)THIADIAZOLE
47DIBROMOBENZO(C)125THIADIAZOLE
C1=C(C2=NSN=C2C(=C1)Br)Br
InChI=1SC6H2Br2N2Sc73124(8)65(3)911106h12H
BBL003499
Synonyms: 1-benzyl-1H-indole-2-carbohydrazide
Smiles: NNC(=O)c1cc2c(n1Cc1ccccc1)cccc2
NNC(=O)c1cc2c(n1Cc1ccccc1)cccc2
ZINC00335845
ZINC335845
1BENZYL1HINDOLE2CARBOHYDRAZIDE
1BENZYLINDOLE2CARBOHYDRAZIDE
27351220
C1=CC=C(C=C1)CN2C3=CC=CC=C3C=C2C(=O)NN
InChI=1SC16H15N3Oc171816(20)151013845914(13)19(15)11126213712h110H1117H2(H1820)
BBL003500
Synonyms: methyl4-amino-3-hydroxybenzoate
Smiles: COC(=O)c1ccc(c(c1)O)N
COC(=O)c1ccc(c(c1)O)N
2AMINO5METHOXYCARBONYLPHENOL
2HYDROXY4CARBOMETHOXYANILINE
3HYDROXY4AMINOBENZOICACIDMETHYLESTER
4AMINO3HYDROXYBENZOICACIDMETHYLESTER
63435165
METHYL3HYDROXY4AMINOBENZOATE
METHYL4AMINO3HYDROXYBENZENECARBOXYLATE
METHYL4AMINO3HYDROXYBENZOATE
MFCD00017093
ZINC000002566107
ZINC02566107
ZINC2566107
COC(=O)C1=CC(=C(C=C1)N)O
InChI=1SC8H9NO3c1128(11)5236(9)7(10)45h2410H9H21H3
BBL003501
Synonyms: 3-(benzylsulfanyl)-1H-1,2,4-triazol-5-amine
Smiles: Nc1[nH]nc(n1)SCc1ccccc1
Nc1(nH)nc(n1)SCc1ccccc1
ZINC000000402553
ZINC00402553
ZINC402553
MFCD00141524
3(BENZYLSULFANYL)1H124TRIAZOL5AMINE
3(BENZYLSULFANYL)1H124TRIAZOL5YLAMINE
3(BENZYLTHIO)1H124TRIAZOL5AMINE
3(PHENYLMETHYLTHIO)1H124TRIAZOLE5YLAMINE
3922472
3AMINO5BENZYLTHIO124TRIAZOLE
3BENZYLSULFANYL1H124TRIAZOL5AMINE
3BENZYLTHIO5AMINO124TRIAZOLE
4H124TRIAZOL3AMINE5((PHENYLMETHYL)THIO)
5(BENZYLSULFANYL)2H124TRIAZOL3AMINE
5(BENZYLSULFANYL)4H124TRIAZOL3AMINE
5(BENZYLTHIO)1H124TRIAZOL3AMINE
5(PHENYLMETHYLTHIO)124TRIAZOLE3YLAMINE
5AMINO3BENZYLTHIO124TRIAZOLE
5AMINO3BENZYLTHIO1H124TRIAZOLE
5BENZYLSULFANYL2H(124)TRIAZOL3YLAMINE
5BENZYLSULFANYL4H(124)TRIAZOL3YLAMINE
BENZYLSULFANYLTRIAZOLYLAMINE
C1=CC=C(C=C1)CSC2=NNC(=N2)N
InChI=1SC9H10N4Sc108119(13128)1467421357h15H6H2(H310111213)
BBL003502
Synonyms: methyl2-amino-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate
Smiles: COC(=O)c1c(N)sc(c1C)C(=O)Nc1ccccc1
COC(=O)c1c(N)sc(c1C)C(=O)Nc1ccccc1
2AMINO4METHYL5PHENYLCARBAMOYLTHIOPHENE3
2AMINO4METHYL5PHENYLCARBAMOYLTHIOPHENE3CARBOXYLICACIDMETHYLESTER
METHYL2AMINO4METHYL5(NPHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
METHYL2AMINO4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
METHYL2AMINO5(ANILINOCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD00159544
ZINC000001441472
ZINC01441472
ZINC1441472
200277856
CC1=C(SC(=C1C(=O)OC)N)C(=O)NC2=CC=CC=C2
InChI=1SC14H14N2O3Sc1810(14(18)192)12(15)2011(8)13(17)169643579h37H15H212H3(H1617)
BBL003503
Synonyms: 2-(1,3-benzothiazol-2-ylsulfanyl)acetohydrazide
Smiles: NNC(=O)CSc1nc2c(s1)cccc2
NNC(=O)CSc1nc2c(s1)cccc2
ZINC000000037396
ZINC00037396
ZINC37396
MFCD00170507
(BENZO(D)THIAZOL2YLSULFANYL)ACETICACIDHYDRAZIDE
(BENZOTHIAZOL2YLSULFANYL)ACETICACIDHYDRAZIDE
2(13BENZOTHIAZOL2YLSULFANYL)ACETOHYDRAZIDE
2(13BENZOTHIAZOL2YLTHIO)ACETOHYDRAZIDE
2(BENZO(D)THIAZOL2YLTHIO)ACETOHYDRAZIDE
2(BENZOTHIAZOL2YLTHIO)ACETOHYDRAZIDE
24044915
2BENZOTHIAZOL2YLTHIOACETOHYDRAZIDE
2BENZOTHIAZOL2YLTHIOACETYLHYDRAZIDE
ACETICACID2(2BENZOTHIAZOLYLTHIO)HYDRAZIDE
C1=CC=C2C(=C1)N=C(S2)SCC(=O)NN
InChI=1SC9H9N3OS2c10128(13)514911631247(6)159h14H510H2(H1213)
BBL003504
Synonyms: 5-methoxy-1H-indole-2,3-dione
Smiles: COc1ccc2c(c1)C(=O)C(=O)N2
COc1ccc2c(c1)C(=O)C(=O)N2
INDOLE23DIONE5METHOXY
ISATINBASEDCOMPOUND31
ZINC02007434
ZINC2007434
1HINDOLE23DIONE5METHOXY
1HINDOLE23DIONE5METHOXY(9CI)
39755958
5HYDROXY1HINDOLE23DIONEMEETHER
5HYDROXY1HINDOLE23DIONEMETHYLETHER
5METHOXY1HBENZO(D)AZOLIDINE23DIONE
5METHOXY1HINDOLE23DIONE
5METHOXY23DIHYDRO1HINDOLE23DIONE
5METHOXY23INDOLINEDIONE
5METHOXYINDOLE23DIONE
5METHOXYINDOLINE23DIONE
5METHOXYISATIN
5METHOXYISATINE
BBL003505
Synonyms: 1,3-diphenyl-1H-pyrazol-5-amine
Smiles: Nc1cc(nn1c1ccccc1)c1ccccc1
Nc1cc(nn1c1ccccc1)c1ccccc1
PYRAZOLE5AMINO13DIPHENYL
ZINC16478004
13DIPHENYL1HPYRAZOL5AMINE
13DIPHENYL1HPYRAZOL5YLAMINE
13DIPHENYL1HPYRAZOLE5AMINE
13DIPHENYL5AMINOPYRAZOLE
13DIPHENYL5PYRAZOLAMINE
13DIPHENYLPYRAZOLE5YLAMINE
1HPYRAZOL5AMINE13DIPHENYL
25DIPHENYL2HPYRAZOL3YLAMINE
25DIPHENYL3PYRAZOLAMINE
25DIPHENYLPYRAZOL3AMINE
5356718
5AMINO13DIPHENYL1HPYRAZOLE
5AMINO13DIPHENYLPYRAZOLE
C1=CC=C(C=C1)C2=NN(C(=C2)N)C3=CC=CC=C3
InChI=1SC15H13N3c16151114(127314812)1718(15)1395261013h111H16H2
BBL003506
Synonyms: 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-sulfanylpyrimidin-4(3H)-one
Smiles: Clc1ccc(cc1)SCc1cc(=O)[nH]c(n1)S
Clc1ccc(cc1)SCc1cc(=O)(nH)c(n1)S
MFCD02255714
ZINC000006493891
ZINC06493891
ZINC18249986
ZINC6493891
354538719
6(((4CHLOROPHENYL)SULFANYL)METHYL)2SULFANYL3HPYRIMIDIN4ONE
6(((4CHLOROPHENYL)SULFANYL)METHYL)2SULFANYLPYRIMIDIN4(3H)ONE
6(((4CHLOROPHENYL)SULFANYL)METHYL)2SULFANYLPYRIMIDIN4OL
6(((4CHLOROPHENYL)THIO)METHYL)2MERCAPTOPYRIMIDIN4(3H)ONE
6((4CHLOROPHENYL)SULFANYLMETHYL)2SULFANYLIDENE1HPYRIMIDIN4ONE
6((4CHLOROPHENYLTHIO)METHYL)2SULFANYLPYRIMIDIN4OL
6(4CHLOROPHENYLSULFANYLMETHYL)2MERCAPTO3HPYRIMIDIN4ONE
C1=CC(=CC=C1SCC2=CC(=O)NC(=S)N2)Cl
InChI=1SC11H9ClN2OS2c127139(427)1768510(15)1411(16)138h15H6H2(H213141516)
BBL003507
Synonyms: 6-{[(4-methylphenyl)sulfanyl]methyl}-2-sulfanylpyrimidin-4(3H)-one
Smiles: Cc1ccc(cc1)SCc1cc(=O)[nH]c(n1)S
Cc1ccc(cc1)SCc1cc(=O)(nH)c(n1)S
MFCD02225924
ZINC000017744101
ZINC17744101
299937818
2MERCAPTO6(((4METHYLPHENYL)THIO)METHYL)PYRIMIDIN4(3H)ONE
2MERCAPTO6((PTOLYLTHIO)METHYL)PYRIMIDIN4(3H)ONE
2MERCAPTO6PTOLYLSULFANYLMETHYL3HPYRIMIDIN4ONE
6(((4METHYLPHENYL)SULFANYL)METHYL)2SULFANYL3HPYRIMIDIN4ONE
6(((4METHYLPHENYL)SULFANYL)METHYL)2SULFANYLPYRIMIDIN4(3H)ONE
6(((4METHYLPHENYL)SULFANYL)METHYL)2SULFANYLPYRIMIDIN4OL
6((4METHYLPHENYL)SULFANYLMETHYL)2SULFANYLIDENE1HPYRIMIDIN4ONE
6((4METHYLPHENYLTHIO)METHYL)2SULFANYLPYRIMIDIN4OL
CC1=CC=C(C=C1)SCC2=CC(=O)NC(=S)N2
InChI=1SC12H12N2OS2c182410(538)1779611(15)1412(16)139h26H7H21H3(H213141516)
BBL003508
Synonyms: 4-(diethylsulfamoyl)benzoicacid
Smiles: CCN(S(=O)(=O)c1ccc(cc1)C(=O)O)CC
CCN(S(=O)(=O)c1ccc(cc1)C(=O)O)CC
ETAMID
ETEBENECID
ETEBENECID(INN)
ETEBENECIDA
ETEBENECIDE
ETEBENECIDE(INNFRENCH)
ETEBENECIDUM
ETEBENECIDUM(INNLATIN)
ETHEBENECID
ETHEBENECIDE
1213065
4((DIETHYLAMINO)SULFONYL)BENZOICACID
PCARBOXYNNDIETHYLBENZENESULFONAMIDE
PDIETHYLSULFAMOYLBENZOICACID
PDIETHYLSULFAMYLBENZOICACID
ZINC1380
4(DIETHYLSULFAMOYL)BENZOICACID
4CARBOXYNNDIETHYLBENZENESULFONAMIDE
4DIETHYLSULFAMOYLBENZOICACID
BENZOICACID4((DIETHYLAMINO)SULFONYL)
BENZOICACID4((DIETHYLAMINO)SULFONYL)(9CI)
BENZOICACIDP(DIETHYLSULFAMOYL)
MFCD00020373
NNDIETHYL4SULFAMOYLBENZOICACID
NNDIETHYLPSULFAMOYLBENZOICACID
P(DIETHYLSULFAMOYL)BENZOICACID
CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O
InChI=1SC11H15NO4Sc1312(42)17(1516)10759(6810)11(13)14h58H34H212H3(H1314)
BBL003509
Synonyms: methyl6-amino-3,4-dihydroquinoline-1(2H)-carboxylate
Smiles: COC(=O)N1CCCc2c1ccc(c2)N
COC(=O)N1CCCc2c1ccc(c2)N
1(2H)QUINOLINECARBOXYLICACID6AMINO34DIHYDROMETHYLESTER
893773961
METHYL6AMINO34DIHYDRO1(2H)QUINOLINECARBOXYLATE
METHYL6AMINO34DIHYDRO2HQUINOLINE1CARBOXYLATE
METHYL6AMINO34DIHYDROQUINOLINE1(2H)CARBOXYLATE
ZINC06659310
ZINC6659310
COC(=O)N1CCCC2=C1C=CC(=C2)N
InChI=1SC11H14N2O2c11511(14)13623879(12)4510(8)13h457H23612H21H3
BBL003510
Synonyms: 1,2-dihydroacenaphthylene-5-carbaldehyde
Smiles: O=Cc1ccc2c3c1cccc3CC2
O=Cc1ccc2c3c1cccc3CC2
ZINC00967400
ZINC967400
12DIHYDRO5ACENAPHTHYLENECARBALDEHYDE
12DIHYDROACENAPHTHYLENE5CARBALDEHYDE
5345460
5ACENAPHTHENECARBALDEHYDE
5ACENAPHTHENECARBOXALDEHYDE
5ACENAPHTHENECARBOXALDEHYDE95
5ACENAPHTHYLENECARBOXALDEHYDE12DIHYDRO
ACENAPHTHENE5CARBALDEHYDE
C1CC2=CC=CC3=C(C=CC1=C23)C=O
InChI=1SC13H10Oc14811761054921312(11)13(9)10h1368H45H2
BBL003511
Synonyms: 4-(benzyloxy)-3-methoxybenzoicacid
Smiles: COc1cc(ccc1OCc1ccccc1)C(=O)O
COc1cc(ccc1OCc1ccccc1)C(=O)O
OBENZYLVANILLICACID
ZINC1747280
3METHOXY4BENZYLOXYBENZOICACID
3METHOXY4PHENYLMETHOXYBENZOICACID
1486539
2METHOXY4CARBOXYPHENOXYPHENYLMETHANE
3METHOXY4(PHENYLMETHOXY)BENZOICACID
4(BENZYLOXY)3METHOXYBENZOICACID
4BENZYLOXY3METHOXYBENZOICACID
4BENZYLVANILLICACID
BENZOICACID3METHOXY4(PHENYLMETHOXY)
BENZYLVANILLICACID
COC1=C(C=CC(=C1)C(=O)O)OCC2=CC=CC=C2
InChI=1SC15H14O4c11814912(15(16)17)7813(14)1910115324611h29H10H21H3(H1617)
BBL003512
Synonyms: (3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)aceticacid
Smiles: OC(=O)Cc1nn(C)c(=O)c2c1cccc2
OC(=O)Cc1nn(C)c(=O)c2c1cccc2
ZINC000000092804
ZINC92804
2(3METHYL4OXO34DIHYDROPHTHALAZIN1YL)ACETICACID
2(3METHYL4OXO3HYDROPHTHALAZINYL)ACETICACID
2(3METHYL4OXOPHTHALAZIN1YL)ACETICACID
(3METHYL4OXO34DIHYDROPHTHALAZIN1YL)ACETI
(3METHYL4OXO34DIHYDROPHTHALAZIN1YL)ACETICACID
(3METHYL4OXOPHTHALAZIN1YL)ACETICACID
1PHTHALAZINEACETICACID34DIHYDRO3METHYL4OXO
28081529
MFCD01192103
CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)O
InChI=1SC11H10N2O3c11311(16)853247(8)9(1213)610(14)15h25H6H21H3(H1415)
BBL003513
Synonyms: N-(1,1-dioxido-1,2-benzothiazol-3-yl)ethane-1,2-diamine
Smiles: NCCNC1=NS(=O)(=O)c2c1cccc2
NCCNC1=NS(=O)(=O)c2c1cccc2
ZINC2379963
3((2AMINOETHYL)AMINO)BENZO(D)12THIAZOLE11DIONE
340018259
N(11DIOXIDO12BENZISOTHIAZOL3YL)ETHANE12DIAMINE
N(11DIOXIDO12BENZOTHIAZOL3YL)ETHANE12DIAMINE
N(11DIOXO12BENZOTHIAZOL3YL)ETHANE12DIAMINE
N(11DIOXO1HBENZO(D)ISOTHIAZOL3YL)ETHANE
N(11DIOXO1HBENZO(D)ISOTHIAZOL3YL)ETHANE12DIAMINE
N1(11DIOXO1H1BENZO(D)ISOTHIAZOL3YL)ETHANE12DIAMINE
N1(11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YL)ETHANE12DIAMINE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCN
InChI=1SC9H11N3O2Sc1056119731248(7)15(1314)129h14H5610H2(H1112)
BBL003514
Synonyms: 5-methyl-7-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Smiles: Cc1nc2nc(nn2c(c1)c1ccccc1)N
Cc1nc2nc(nn2c(c1)c1ccccc1)N
5METHYL7PHENYL124TRIAZOLO(15A)PYRIMIDIN2AMINE
5METHYL7PHENYL8HYDRO124TRIAZOLO(15A)PYRIMIDINE2YLAMINE
72966199
ZINC00617554
ZINC617554
5METHYL7PHENYL(124)TRIAZOLO(15A)PYRIMIDIN2AMINE
5METHYL7PHENYL(124)TRIAZOLO(15A)PYRIMIDIN2YLAMINE
5METHYL7PHENYL(124)TRIAZOLO(15A)PYRIMIDINE2AMINE
CC1=NC2=NC(=NN2C(=C1)C3=CC=CC=C3)N
InChI=1SC12H11N5c18710(9532469)1712(148)1511(13)1617h27H1H3(H21316)
BBL003515
Synonyms: 2-(3-methoxyphenoxy)ethanamine
Smiles: NCCOc1cccc(c1)OC
NCCOc1cccc(c1)OC
ZINC000002597400
ZINC2597400
1(2AMINOETHOXY)3METHOXYBENZENE
2(3METHOXYPHENOXY)ETHANAMINE
2(3METHOXYPHENOXY)ETHYLAMINE
6487861
ETHANAMINE2(3METHOXYPHENOXY)
MFCD02598966
COC1=CC(=CC=C1)OCCN
InChI=1SC9H13NO2c11183249(78)126510h247H5610H21H3
BBL003516
Synonyms: 1-(methylsulfonyl)-2,3-dihydro-1H-indole-5-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)CCN2S(=O)(=O)C
OC(=O)c1ccc2c(c1)CCN2S(=O)(=O)C
ZINC000000615416
ZINC615416
MFCD05625163
1(METHYLSULFONYL)23DIHYDRO1HINDOLE5CARBOXYLICACID
1(METHYLSULFONYL)5INDOLINECARBOXYLICACID
1(METHYLSULFONYL)INDOLINE5CARBOXYLICACID
1HINDOLE5CARBOXYLICACID23DIHYDRO1(METHYLSULFONYL)
1METHANESULFONYL23DIHYDRO1HINDOLE5CARBOXYLICACID
1METHANESULFONYL23DIHYDROINDOLE5CARBOXYLICACID
1METHYLSULFONYL23DIHYDROINDOLE5CARBOXYLICACID
712319443
CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)O
InChI=1SC10H11NO4Sc116(1415)1154768(10(12)13)239(7)11h236H45H21H3(H1213)
BBL003517
Synonyms: 4-(pyridin-3-yloxy)aniline
Smiles: Nc1ccc(cc1)Oc1cccnc1
Nc1ccc(cc1)Oc1cccnc1
ZINC04384294
ZINC4384294
4(3PYRIDINYLOXY)PHENYLAMINE
4(3PYRIDYLOXY)ANILINE
4(3PYRIDYLOXY)PHENYLAMINE
4(PYRIDIN3YLOXY)ANILINE
4(PYRIDIN3YLOXY)PHENYLAMINE
4PYRIDIN3YLOXYANILINE
80650459
BENZENAMINE4(3PYRIDINYLOXY)
C1=CC(=CN=C1)OC2=CC=C(C=C2)N
InChI=1SC11H10N2Oc1293510(649)141121713811h18H12H2
BBL003518
Synonyms: 2-[2-methyl-5-(propan-2-yl)phenoxy]ethanamine
Smiles: NCCOc1cc(ccc1C)C(C)C
NCCOc1cc(ccc1C)C(C)C
ZINC000004998651
ZINC4998651
MFCD06247884
(2(5ISOPROPYL2METHYLPHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(2METHYL5(METHYLETHYL)PHENOXY)ETHYLAMINE
2(2METHYL5(PROPAN2YL)PHENOXY)ETHANAMINE
2(2METHYL5PROPAN2YLPHENOXY)ETHANAMINE
2(5ISOPROPYL2METHYLPHENOXY)ETHYLAMINE
26646606
CC1=C(C=C(C=C1)C(C)C)OCCN
InChI=1SC12H19NOc19(2)115410(3)12(811)147613h4589H6713H213H3
BBL003519
Synonyms: 3-phenyl-1H-pyrazole-4-carbaldehyde
Smiles: O=Cc1c[nH]nc1c1ccccc1
O=Cc1c(nH)nc1c1ccccc1
ZINC04576328
ZINC4576328
1HPYRAZOLE4CARBOXALDEHYDE3PHENYL
26033205
3PHENYL1HPYRAZOL4CARBALDEHYD
3PHENYL1HPYRAZOLE4CARBALDEHYDE
3PHENYL1HPYRAZOLE4CARBOXALDEHYDE
3PHENYL2HPYRAZOLE4CARBALDEHYDE
3PHENYL4PYRAZOLECARBOXALDEHYDE
3PHENYLPYRAZOLE4CARBALDEHYDE
3PHENYLPYRAZOLE4CARBOXALDEHYDE
4FORMYL3PHENYLPYRAZOLE
5PHENYL1HPYRAZOLE4CARBALDEHYDE
5PHENYLPYRAZOLE4CARBALDEHYDE
C1=CC=C(C=C1)C2=C(C=NN2)C=O
InChI=1SC10H8N2Oc13796111210(9)8421358h17H(H1112)
BBL003520
Synonyms: 2-(piperidin-1-yl)propanoicacid
Smiles: CC(C(=O)O)N1CCCCC1
CC(C(=O)O)N1CCCCC1
2(1PIPERIDINYL)PROPANOICACID
2(PIPERIDIN1YL)PROPANOICACID
2PIPERIDIN1YLPROPANOICACID
2PIPERIDIN1YLPROPIONICACID
2PIPERIDYLPROPANOICACID
69181711
InChI=1SC8H15NO2c17(8(10)11)9532469h7H26H21H3(H1011)
BBL003521
Synonyms: 4-methyl-2-phenyl-5-(pyridin-3-ylmethyl)-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
Smiles: O=c1cc2[nH]n(c(=O)c2c(n1Cc1cccnc1)C)c1ccccc1
O=c1cc2(nH)n(c(=O)c2c(n1Cc1cccnc1)C)c1ccccc1
ZINC04741476
ZINC102492492
ZINC4741476
ZINC49937870
4METHYL2PHENYL5(3PYRIDYLMETHYL)5HYDRO3PYRAZOLINO(43C)PYRIDINE36DIONE
4METHYL2PHENYL5(PYRIDIN3YLMETHYL)1HPYRAZOLIDINO(43C)PYRIDINE36DIONE
4METHYL2PHENYL5(PYRIDIN3YLMETHYL)1HPYRAZOLO(43C)PYRIDINE36(2H5H)DIONE
4METHYL2PHENYL5(PYRIDIN3YLMETHYL)1HPYRAZOLO(43C)PYRIDINE36DIONE
6HYDROXY4METHYL2PHENYL5(PYRIDIN3YLMETHYL)25DIHYDRO3HPYRAZOLO(43C)PYRIDIN3ONE
847572558
CC1=C2C(=CC(=O)N1CC3=CN=CC=C3)NN(C2=O)C4=CC=CC=C4
InChI=1SC19H16N4O2c1131816(2123(19(18)25)157324815)1017(24)22(13)1214659201114h21121H12H21H3
BBL003522
Synonyms: 1-methyl-3-phenyl-1H-pyrazol-5-amine
Smiles: Cn1nc(cc1N)c1ccccc1
Cn1nc(cc1N)c1ccccc1
ZINC00095216
ZINC95216
10199505
1HPYRAZOL5AMINE1METHYL3PHENYL
1METHYL3PHENYL1HPYRAZOL5AMINE
1METHYL3PHENYLPYRAZOL5AMINE
1METHYL3PHENYLPYRAZOLE5YLAMINE
2METHYL5PHENYL2HPYRAZOL3YLAMINE
2METHYL5PHENYLPYRAZOL3AMINE
5AMINO1METHYL3PHENYL1HPYRAZOLE
5AMINO1METHYL3PHENYLPYRAZOLE
CN1C(=CC(=N1)C2=CC=CC=C2)N
InChI=1SC10H11N3c11310(11)79(1213)8532468h27H11H21H3
BBL003523
Synonyms: 4-aminobenzohydrazide
Smiles: NNC(=O)c1ccc(cc1)N
NNC(=O)c1ccc(cc1)N
PAMINOBENZHYDRAZIDE
PAMINOBENZOICACIDHYDRAZIDE
PAMINOBENZOICHYDRAZIDE
PAMINOBENZOYLHYDRAZIDE
PAMINOBENZOYLHYDRAZINE
PARAAMINOBENZHYDRAZIDE
MFCD00007606
MYELOPEROXIDASEINHIBITORI
4AMINOBENZHYDRAZIDE
4AMINOBENZOHYDRAZIDE
ZINC000000134424
ZINC00134424
ZINC134424
4AMINOBENZOICACIDHYDRAZIDE
4AMINOBENZOICHYDRAZIDE
4AMINOBENZOYLHYDRAZIDE
4AMINOBENZOYLHYDRAZINE
4AZANYLBENZOHYDRAZIDE
4PHENYLAMINE
5351177
AMBENHYDRAZIDE
AMINOSTIMIL
BENZOICACID4AMINOHYDRAZIDE
BENZOICACID4AMINOHYDRAZIDE(9CI)
BENZOICACIDPAMINOHYDRAZIDE
C1=CC(=CC=C1C(=O)NN)N
InChI=1SC7H9N3Oc86315(246)7(11)109h14H89H2(H1011)
BBL003524
Synonyms: 2-[5-methyl-2-(propan-2-yl)phenoxy]acetohydrazide
Smiles: NNC(=O)COc1cc(C)ccc1C(C)C
NNC(=O)COc1cc(C)ccc1C(C)C
ZINC000000139027
ZINC00139027
ZINC139027
MFCD00587500
(2ISOPROPYL5METHYLPHENOXY)ACETICACIDHYDRAZIDE
2(2ISOPROPYL5METHYLPHENOXY)ACETOHYDRAZIDE
2(5METHYL2(METHYLETHYL)PHENOXY)ACETOHYDRAZIDE
2(5METHYL2(PROPAN2YL)PHENOXY)ACETOHYDRAZIDE
2(5METHYL2PROPAN2YLPHENOXY)ACETOHYDRAZIDE
2ISOPROPYL5METHYLPHENOXYACETOHYDRAZIDE
75843515
ACETICACID2(5METHYL2(1METHYLETHYL)PHENOXY)HYDRAZIDE
CC1=CC(=C(C=C1)C(C)C)OCC(=O)NN
InChI=1SC12H18N2O2c18(2)10549(3)611(10)16712(15)1413h468H713H213H3(H1415)
BBL003525
Synonyms: 3-(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)propanoicacid
Smiles: OC(=O)CCn1c(=O)oc2c1ccc(c2)Cl
OC(=O)CCn1c(=O)oc2c1ccc(c2)Cl
ZINC4218219
17124560
3(6CHLORO2OXO13BENZOXAZOL3(2H)YL)PROPANOICACID
3(6CHLORO2OXO13BENZOXAZOL3YL)PROPANOICACID
3(6CHLORO2OXO3HYDROBENZOXAZOL3YL)PROPANOICACID
3(6CHLORO2OXOBENZO(D)OXAZOL3(2H)YL)PROPANOICACID
3(6CHLORO2OXOBENZOOXAZOL3YL)PROPIONICACID
C1=CC2=C(C=C1Cl)OC(=O)N2CCC(=O)O
InChI=1SC10H8ClNO4c1161278(56)1610(15)12(7)439(13)14h125H34H2(H1314)
BBL003526
Synonyms: 3-(2-methoxyphenyl)-1H-pyrazole-5-carboxylicacid
Smiles: COc1ccccc1c1n[nH]c(c1)C(=O)O
COc1ccccc1c1n(nH)c(c1)C(=O)O
MFCD03030186
ZINC000006848891
ZINC6848891
1HPYRAZOLE3CARBOXYLICACID5(2METHOXYPHENYL)
3(2METHOXYPHENYL)1HPYRAZOLE5CARBOXYLICACID
3(2METHOXYPHENYL)PYRAZOLE5CARBOXYLICACID
5(2METHOXYPHENYL)1HPYRAZOLE3CARBOXYLICACID
5(2METHOXYPHENYL)2HPYRAZOLE3
5(2METHOXYPHENYL)2HPYRAZOLE3CARBOXYLICACID
834868541
COC1=CC=CC=C1C2=NNC(=C2)C(=O)O
InChI=1SC11H10N2O3c1161053247(10)869(11(14)15)13128h26H1H3(H1213)(H1415)
BBL003527
Synonyms: 5-(pyridin-3-yl)-1,3,4-oxadiazole-2-thiol
Smiles: Sc1nnc(o1)c1cccnc1
Sc1nnc(o1)c1cccnc1
ZINC1254432
PYRIDINYLOXADIAZOLETHIOL
134OXADIAZOLE2(3H)THIONE5(3PYRIDINYL)
134OXADIAZOLE2THIOL5(3PYRIDINYL)
2MERCAPTO5(PYRID3YL)134OXADIAZOLE
3690468
5(3PYRIDINYL)134OXADIAZOLE2(3H)THIONE
5(3PYRIDINYL)134OXADIAZOLE2THIOL
5(3PYRIDYL)134OXADIAZOLE2THIOL
5(3PYRIDYL)134OXADIAZOLINE2THIONE
5(3PYRIDYL)2MERCAPTO134OXADIAZOLE
5(PYRIDIN3YL)134OXADIAZOLE2(3H)THIONE
5(PYRIDIN3YL)134OXADIAZOLE2THIOL
5(PYRIDIN3YL)23DIHYDRO134OXADIAZOLE2THIONE
5PYRIDIN3YL(134)OXADIAZOLE2THIOL
5PYRIDIN3YL134OXADIAZOLE2THIOL
5PYRIDIN3YL3H134OXADIAZOLE2THIONE
C1=CC(=CN=C1)C2=NNC(=S)O2
InChI=1SC7H5N3OSc1271096(117)5213845h14H(H1012)
BBL003528
Synonyms: 5-methyl-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Smiles: Cc1nc2nc(nn2c(c1)C(F)(F)F)N
Cc1nc2nc(nn2c(c1)C(F)(F)F)N
ZINC04739363
ZINC4739363
339201693
5METHYL7(TRIFLUOROMETHYL)(124)TRIAZOLO(15A)PYRIMIDIN2AMINE
5METHYL7TRIFLUOROMETHYL(124)TRIAZOLO(15A)PYRIMIDIN2YLAMINE
CC1=NC2=NC(=NN2C(=C1)C(F)(F)F)N
InChI=1SC7H6F3N5c1324(7(89)10)156(123)135(11)1415h2H1H3(H21114)
BBL003529
Synonyms: 6-methyl-1,2,4-triazine-3,5(2H,4H)-dione
Smiles: Cc1n[nH]c(=O)[nH]c1=O
Cc1n(nH)c(=O)(nH)c1=O
124TRIAZINE35(2H4H)DIONE6METHYL
124TRIAZINE35(2H4H)DIONE6METHYL(9CI)
ZINC11666592
14TRIAZINE35(2H4H)DIONE6METHYL
5HYDROXY6METHYL124TRIAZIN3(2H)ONE
5METHYL6AZAURACIL
6AZA24DIHYDORXY5METHYLPYRIMIDINE
6AZA24DIHYDROXY5METHYLPYRIMIDINE
6AZATHYMINE
6METHYL124TRIAZINE35(2H4H)DIONE
6METHYL124TRIAZINE35DIOL
6METHYL124TRIAZINE35DIONE
6METHYL14TRIAZINE35DIONE
6METHYL2H(124)TRIAZINE35DIONE
6METHYL2H124TRIAZINE35DIONE
6METHYL2H4H124TRIAZINE35DIONE
6METHYLASTRIAZINE34H)DIONE
6METHYLASTRIAZINE35(2H4H)DIONE
6METHYLASTRIAZINE35DIOL
932536
ASTRIAZINE34H)DIONE6METHYL
ASTRIAZINE35(2H4H)DIONE6METHYL
ASTRIAZINE35DIOL6METHYL
AZATHYMINE
AZATHYMINE6
35DIHYDROXY6METHYL124TRIAZINE
CC1=NNC(=O)NC1=O
InChI=1SC4H5N3O2c123(8)54(9)762h1H3(H25789)
BBL003530
Synonyms: pyridine-2-carbohydrazide
Smiles: NNC(=O)c1ccccn1
NNC(=O)c1ccccn1
PICOLINICACIDHYDRAZIDE
PICOLINICHYDRAZIDE
PICOLINOHYDRAZIDE
PYRIDIN2CARBOXYLICACIDHYDRAZIDE
PYRIDINE2CARBOHYDRAZIDE
PYRIDINE2CARBOXYLICACIDHYDRAZIDE
PYRIDINECARBOXYLICACIDHYDRAZIDE
ZINC000000010573
ZINC00010573
ZINC10573
1452637
2PICOLINYLHYDRAZIDE
2PYRIDINECARBOHYDRAZIDE
2PYRIDINECARBOXYLICACIDHYDRAZIDE
ALPHAPICOLINYLHYDRAZIDE
MFCD00059782
C1=CC=NC(=C1)C(=O)NN
InChI=1SC6H7N3Oc796(10)5312485h14H7H2(H910)
BBL003531
Synonyms: [(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]aceticacid
Smiles: Cn1cnnc1SCC(=O)O
Cn1cnnc1SCC(=O)O
ZINC1323929
(4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETICACID
(4METHYL4H124TRIAZOL3YLSULFANYL)ACETICACID
2(4METHYL124TRIAZOL3YLTHIO)ACETICACID
((4METHYL124TRIAZOL3YL)SULFANYL)ACETICACID
((4METHYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
((4METHYL4H124TRIAZOL3YL)THIO)ACETICACID
(4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETIC
2((4METHYL124TRIAZOL3YL)SULFANYL)ACETICACID
2((4METHYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
2((4METHYL4H124TRIAZOL3YL)THIO)ACETICACID
200816064
CN1C=NN=C1SCC(=O)O
InChI=1SC5H7N3O2Sc183675(8)1124(9)10h3H2H21H3(H910)
BBL003532
Synonyms: 4-(imidazo[1,2-a]pyridin-2-yl)aniline
Smiles: Nc1ccc(cc1)c1nc2n(c1)cccc2
Nc1ccc(cc1)c1nc2n(c1)cccc2
ZINC00072649
ZINC72649
IMIDAZOAPYRIDINYLPHENYLAMINE
139705741
2(4AMINOPHENYL)IMIDAZO(12A)PYRIDINE
4(4HYDROIMIDAZO(12A)PYRIDIN2YL)PHENYLAMINE
4(IMIDAZO(12A)PYRIDIN2YL)ANILINE
4(IMIDAZO(12A)PYRIDIN2YL)PHENYLAMINE
4IMIDAZO(12A)PYRIDIN2YLANILINE
4IMIDAZO(12A)PYRIDIN2YLPHENYLAMINE
BENZENAMINE4IMIDAZO(12A)PYRIDIN2YL
C1=CC2=NC(=CN2C=C1)C3=CC=C(C=C3)N
InChI=1SC13H11N3c14116410(5711)12916821313(16)1512h19H14H2
BBL003533
Synonyms: 3-(butanoylamino)benzoicacid
Smiles: CCCC(=O)Nc1cccc(c1)C(=O)O
CCCC(=O)Nc1cccc(c1)C(=O)O
ZINC64981
3(BUTANOYLAMINO)BENZOICACID
3(BUTYRYLAMINO)BENZOICACID
3BUTANAMIDOBENZOICACID
3BUTYRAMIDOBENZOICACID
76209002
BENZOICACID3((1OXOBUTYL)AMINO)
CCCC(=O)NC1=CC=CC(=C1)C(=O)O
InChI=1SC11H13NO3c12410(13)1296358(79)11(14)15h357H24H21H3(H1213)(H1415)
BBL003534
Synonyms: 4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
Smiles: CCn1c(S)nnc1c1ccncc1
CCn1c(S)nnc1c1ccncc1
ZINC18249978
26029016
3H124TRIAZOLE3THIONE4ETHYL24DIHYDRO5(4PYRIDINYL)
4ETHYL3(4PYRIDYL)1H124TRIAZOLE5THIONE
4ETHYL3PYRIDIN4YL1H124TRIAZOLE5THIONE
4ETHYL5(4PYRIDINYL)2H124TRIAZOLE3(4H)THIONE
4ETHYL5(4PYRIDINYL)4H124TRIAZOLE3THIOL
4ETHYL5(4PYRIDYL)124TRIAZOLE3THIOL
4ETHYL5(PYRIDIN4YL)124TRIAZOLE3THIOL
4ETHYL5(PYRIDIN4YL)24DIHYDRO3H124TRIAZOLE3THIONE
4ETHYL5(PYRIDIN4YL)2H124TRIAZOLE3THIONE
4ETHYL5(PYRIDIN4YL)4H124TRIAZOLE3THIOL
4ETHYL5PYRIDIN4YL24DIHYDRO(124)TRIAZOLE3THIONE
4ETHYL5PYRIDIN4YL4H(124)TRIAZOLE3THIOL
4ETHYL5PYRIDIN4YL4H124TRIAZOLE3THIOL
4H(124)TRIAZOLE3THIOL4ETHYL5PYRIDIN4YL
CCN1C(=NNC1=S)C2=CC=NC=C2
InChI=1SC9H10N4Sc12138(11129(13)14)73510647h36H2H21H3(H1214)
BBL003535
Synonyms: 4-(dipropylamino)benzaldehyde
Smiles: CCCN(c1ccc(cc1)C=O)CCC
CCCN(c1ccc(cc1)C=O)CCC
4(DIPROPYLAMINO)BENZALDEHYDE
4DIPROPYLAMINOBENZALDEHYDE
613285
BENZALDEHYDE4(DIPROPYLAMINO)
MFCD01014246
P(DIPROPYLAMINO)BENZALDEHYDE
PDIPROPYLAMINOBENZALDEHYDE
ZINC000001583083
ZINC01583083
ZINC1583083
4(NNDIPROPYLAMINO)BENZALDEHYDE
CCCN(CCC)C1=CC=C(C=C1)C=O
InChI=1SC13H19NOc13914(1042)137512(1115)6813h5811H34910H212H3
BBL003536
Synonyms: 2,5-diethoxyaniline
Smiles: CCOc1ccc(c(c1)N)OCC
CCOc1ccc(c(c1)N)OCC
MFCD00015144
ZINC000000157614
ZINC00157614
ZINC157614
(25DIETHOXYPHENYL)AMINE
25DIETHOXYANILINE
25DIETHOXYPHENYLAMINE
94859
AMINOHYDROQUINONEDIETHYLETHER
ANILINE25DIETHOXY
ANILINE25DIETHOXY(8CI)
ANILINE5DIETHOXY
BENZENAMINE25DIETHOXY
BENZENAMINE5DIETHOXY
CCOC1=CC(=C(C=C1)OCC)N
InChI=1SC10H15NO2c131285610(1342)9(11)78h57H3411H212H3
BBL003537
Synonyms: (3-aminophenyl)methanol
Smiles: OCc1cccc(c1)N
OCc1cccc(c1)N
ZINC000003861383
ZINC03861383
ZINC3861383
MAMINOBENZYLALCOHOL
MAMINOPHENYLCARBINOL
METAAMINOBENZYLALCOHOL
MFCD00007817
(3AMINOPHENYL)METHAN1OL
(3AMINOPHENYL)METHANOL
1877776
3(HYDROXYMETHYL)ANILINE
3AMINOBENZENEMETHANOL
3AMINOBENZYLALCOHOL
3AMINOPHENYLMETHANOL
3AMNIOBENZYLALCOHOL
BENZENEMETHANOL3AMINO
BENZENEMETHANOL3AMINO(9CI)
BENZYLALCOHOLMAMINO
C1=CC(=CC(=C1)N)CO
InChI=1SC7H9NOc873126(47)59h149H58H2
BBL003538
Synonyms: N-phenyl-N-[(Z)-phenylmethylidene]amineoxide
Smiles: [O-]/[N+](=C\c1ccccc1)/c1ccccc1
(O)(N+)(=Cc1ccccc1)c1ccccc1
(Z)BENZYLIDENE(PHENYL)AZANEOXIDE
1137968
ALPHANDIPHENYLNITRONE
AMINOPHENYL(PHENYLMETHYLENE)1OL
BENZALDEHYDEPHENYLNITRONE
BENZENAMINEN(PHENYLMETHYLENE)NOXIDE
BENZENEMETHANIMINEALPHAPHENYLNOXIDE
N1DIPHENYLMETHANIMINEOXIDE
NALPHADIPHENYLNITRONE
NPHENYLN((Z)PHENYLMETHYLIDENE)AMINEOXIDE
ZINC00400554
ZINC70463508
CNDIPHENYLNITRONE
DIPHENYLNITRONE
C1=CC=C(C=C1)C=(N+)(C2=CC=CC=C2)(O)
InChI=1SC13H11NOc1514(1395261013)11127314812h111Hb1411
BBL003539
Synonyms: 4-chloro-3-nitro-5-sulfamoylbenzoicacid
Smiles: OC(=O)c1cc([N+](=O)[O-])c(c(c1)S(=O)(=O)N)Cl
OC(=O)c1cc((N+)(=O)(O))c(c(c1)S(=O)(=O)N)Cl
ZINC4521326
22892962
2CHLORO3NITRO5CARBOXYBENZENESULPHONAMIDE
3(AMINOSULFONYL)4CHLORO5NITROBENZOICACID
3NITRO4CHLORO5SULFAMOYLBENZOICACID
4CHLORANYL3NITRO5SULFAMOYLBENZOICACID
4CHLORO3NITRO5SULFAMOYLBENZOICACID
4CHLORO3NITRO5SULPHAMOYLBENZOICACID
4CHLORO3NITRO5SULPHAMYLBENZOICACID
4CHLORO5NITRO3SULFAMOYLBENZOICACID
5AMINOSULFONYL4CHLORO3NITROBENZOICACID
BENZOICACID3(AMINOSULFONYL)4CHLORO5NITRO
C1=C(C=C(C(=C1(N+)(=O)(O))Cl)S(=O)(=O)N)C(=O)O
InChI=1SC7H5ClN2O6Sc864(10(13)14)13(7(11)12)25(6)17(915)16h12H(H1112)(H291516)
BBL003540
Synonyms: 2-hydroxy-4-methylpentanoicacid
Smiles: OC(C(=O)O)CC(C)C
OC(C(=O)O)CC(C)C
PENTANOICACID2HYDROXY4METHYL
PENTANOICACID2HYDROXY4METHYL(2S)
PENTANOICACID2HYDROXY4METHYL(S)
2HYDROXY4METHYLVALERATE
2HYDROXY4METHYLVALERICACID
2HYDROXYISOCAPROATE
2HYDROXYISOCAPROICACID
2HYDROXYISOHEXANOATE
2HYDROXYISOHEXANOICACID
498362
4METHYL2OXIDANYLPENTANOICACID
AHYDROXYISOCAPROATE
AHYDROXYISOCAPROICACID
ALPHAHYDROXYISOCAPROATE
ALPHAHYDROXYISOCAPROICACID
DALPHAHYDROXYISOCAPROICACID
DL2HYDROXY4METHYLPENTANOATE
DL2HYDROXY4METHYLPENTANOICACID
DL2HYDROXY4METHYLVALERICACID
DL2HYDROXYISOCAPROATE
DL2HYDROXYISOCAPROICACID
DLAHYDROXYISOCAPROATE
DLAHYDROXYISOCAPROICACID
DLALPHAHYDROXYISOCAPROATE
DLALPHAHYDROXYISOCAPROICACID
2HYDROXY4METHYLPENTANOATE
2HYDROXY4METHYLPENTANOICACID
HYDROXYISOCAPROICACID
LEUCINATE
LEUCINICACID
CC(C)CC(C(=O)O)O
InChI=1SC6H12O3c14(2)35(7)6(8)9h457H3H212H3(H89)
BBL003541
Synonyms: 1H-imidazole-4-carboxylicacid
Smiles: OC(=O)c1c[nH]cn1
OC(=O)c1c(nH)cn1
ZINC4720641
1HIMIDAZOLE5CARBOXYLICACID
4(5)IMIDAZOLECARBOXYLICACID
IMIDAZOLE4CARBOXYLICACID
IMIDAZOLE5CARBOXYLICACID
IMIDAZOL4CARBOXYLICACID
(1HIMIDAZOL4YL)CARBOXYLICACID
1072840
1HIMIDAZOLE4CARBOXYLICACID
3HIMIDAZOLE4CARBOXYLICACID
4CARBOXY1HIMIDAZOLE
4CARBOXYIMIDAZOLE
4IMIDAZOLECARBOXYLICACID
5CARBOXY1HIMIDAZOLE
5IMIDAZOLICACID
C1=C(NC=N1)C(=O)O
InChI=1SC4H4N2O2c74(8)315263h12H(H56)(H78)
BBL003542
Synonyms: 3-(2-bromo-4-methylphenyl)-1,3-oxazolidin-2-one
Smiles: Cc1ccc(c(c1)Br)N1CCOC1=O
Cc1ccc(c(c1)Br)N1CCOC1=O
ZINC19093363
1060817686
3(2BROMO4METHYLPHENYL)13OXAZOLIDIN2ONE
3(2BROMO4METHYLPHENYL)13OXAZOLIDIN2ONE95
3(2BROMO4METHYLPHENYL)OXAZOLIDIN2ONE
CC1=CC(=C(C=C1)N2CCOC2=O)Br
InChI=1SC10H10BrNO2c17239(8(11)67)12451410(12)13h236H45H21H3
BBL003543
Synonyms: 4-(2,3-dihydro-1H-indol-1-yl)-1,3,5-triazin-2-amine
Smiles: Nc1ncnc(n1)N1CCc2c1cccc2
Nc1ncnc(n1)N1CCc2c1cccc2
ZINC04737052
ZINC4737052
4(23DIHYDRO1HINDOL1YL)135TRIAZIN2AMINE
4(23DIHYDROINDOL1YL)135TRIAZIN2AMINE
4(INDOLIN1YL)135TRIAZIN2AMINE
4INDOLINYL135TRIAZINE2YLAMINE
879615846
C1CN(C2=CC=CC=C21)C3=NC(=NC=N3)N
InChI=1SC11H11N5c12101371411(1510)1665831249(8)16h147H56H2(H212131415)
BBL003544
Synonyms: 4-amino-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)C
Nc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)C
SOLFAMERAZINA
SOLFAMERAZINA(DCIT)
SULFAMERADINE
SULFAMERAZIN
SULFAMERAZINA
SULFAMERAZINE
SULFAMERAZINE(INN)
SULFAMERAZINE(PHENYL13C6)
SULFAMERAZINE(TRISULFAPYRIMIDINES)
SULFAMERAZINE(USANINNBAN)
SULFAMERAZINE(USPINNBAN)
SULFAMERAZINUM
SULFAMERAZINUM(INNLATIN)
SULFAMETHYLDIAZINE
SULFANILAMIDEN(SUP1)(4METHYL2PYRIMIDINYL)
SULFANILAMIDEN1(4METHYL2PYRIMIDINYL)
SULFANILAMIDEN1(4METHYL2PYRIMIDINYL)(8CI)
SULPHAMERAZINE
SUSFAMERAZINE
VETAMERAZINE
ZINC000000057501
ZINC00057501
ZINC57501
127797
2(4AMINOBENZENESULFONAMIDO)4METHYLPYRIMIDINE
2(PAMINOBENZOLSULFONAMIDO)4METHYLPYRIMIDIN
2(PAMINOBENZOLSULFONAMIDO)4METHYLPYRIMIDINE
2(PAMINOBENZOSULFONAMIDO)4METHYLPYRIMIDINE
2(SULFANILAMIDO)4METHYLPYRIMIDINE
2SULFA4METHYLPYRIMIDINE
2SULFANILAMIDO4METHYLPYRIMIDINE
4AMINON(4METHYL2PYRIMIDINYL)BENZENESULFONAMIDE
4AMINON(4METHYL2PYRIMIDINYL)BENZENESULFONAMIDE(9CI)
4AMINON(4METHYLPYRIMIDIN2YL)BENZENE1SULFONAMIDE
4AMINON(4METHYLPYRIMIDIN2YL)BENZENESULFONAMIDE
4AZANYLN(4METHYLPYRIMIDIN2YL)BENZENESULFONAMIDE
BENZENESULFONAMIDE4AMINON(4METHYL2PYRIMIDINYL)
((4AMINOPHENYL)SULFONYL)(4METHYLPYRIMIDIN2YL)AMINE
(PAMINOBENZOLSULFONYL)2AMINO4METHYLPYRIMIDIN
METILSULFAZIN
MFCD00023212
N(1)(4METHYL2PYRIMIDINYL)SULFANILAMIDE
N(4METHYL2PYRIMIDYL)SULFANILAMIDE
N(SUP1)(4METHYL2PYRIMIDINYL)SULFANILAMIDE
N1(4METHYL2PYRIMIDINYL)SULFANILAMIDE
N1(4METHYLPYRIMIDIN2YL)SULFANILAMIDE
KELAMERAZINE
METHYLPYRIMAL
METHYLSULFADIAZINE
METHYLSULFAZIN
METHYLSULFAZINE
METILSULFADIAZIN
CREMOMERAZINE
CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI=1SC11H12N4O2Sc18671311(148)1518(1617)10429(12)3510h27H12H21H3(H131415)
BBL003545
Synonyms: N-(4-chloro-2,5-dimethoxyphenyl)-3-oxobutanamide
Smiles: COc1cc(Cl)c(cc1NC(=O)CC(=O)C)OC
COc1cc(Cl)c(cc1NC(=O)CC(=O)C)OC
25DIMETHOXY4CHLOROACETOACETANILIDE
4433798
4CHLORO25DIMETHOXYACETOACETANILIDE
ACETOACET25DIMETHOXY4CHLOROANILIDE
ACETOACET25DIMETHXOY4CHLORANILIDE(NAPHTHOLASIRG)
ACETOACETANILIDE4CHLORO25DIMETHOXY
ACETOACETANILIDE4CHLORO25DIMETHOXY(8CI)
ACETOACETYL25DIMETHOXY4CHLOROANILIDE
BUTANAMIDEN(4CHLORO25DIMETHOXYPHENYL)3OXO
N(4CHLORANYL25DIMETHOXYPHENYL)3OXIDANYLIDENEBUTANAMIDE
N(4CHLORO25DIMETHOXYPHENYL)3OXOBUTANAMIDE
N(4CHLORO25DIMETHOXYPHENYL)ACETOACETAMIDE
NAPHTANILIDELRG
NAPHTHOLAS13GH
NAPHTHOLASIRG
NAPHTOLASIRG
NAPHTOLASLGLL
ZINC01682065
ZINC1682065
CC(=O)CC(=O)NC1=CC(=C(C=C1OC)Cl)OC
InChI=1SC12H14ClNO4c17(15)412(16)149610(172)8(13)511(9)183h56H4H213H3(H1416)
BBL003546
Synonyms: 4-(methylsulfonyl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)S(=O)(=O)C
OC(=O)c1ccc(cc1)S(=O)(=O)C
P(METHYLSULFONYL)BENZOICACID
P(METHYLSULPHONYL)BENZOICACID
PMETHYLSULFONYLBENZOICACID
ZINC000000153751
ZINC153751
MFCD00007564
4(METHANESULFONYL)BENZOICACID
4(METHYLSULFONYL)BENZOICACID
4(METHYLSULPHONYL)BENZOICACID
4052306
4CARBOXYPHENYLMETHYLSULPHONE
4METHANESULFONYLBENZOICACID
4METHANSULFONYLBENZOICACID
4METHYLSULFONYLBENZOICACID
4METHYLSULPHONYLBENZOICACID
4METHYLSULPHONYLBENZOICACID95
BENZOICACID4(METHYLSULFONYL)
BENZOICACIDP(METHYLSULFONYL)
CS(=O)(=O)C1=CC=C(C=C1)C(=O)O
InChI=1SC8H8O4Sc113(1112)7426(357)8(9)10h25H1H3(H910)
BBL003547
Synonyms: N-carbamoylasparticacid
Smiles: OC(=O)CC(C(=O)O)NC(=O)N
OC(=O)CC(C(=O)O)NC(=O)N
UREIDOSUCCINICACID
ZINC000000895230
2UREIDOSUCCINICACID
CARBAMOYLASPARTATE
CARBAMOYLASPARTICACID
CARBAMOYLDLASPARTICACID
CARBAMOYLLASPARTATE
CARBAMYLLASPARTATE
CARBAMYULASPARTATE
CARBAMYULLASPARTATE
DLASPARTICACIDN(AMINOCARBONYL)
DLUREIDOSUCCINICACID
2((AMINOCARBONYL)AMINO)SUCCINICACID
2(AMINOCARBONYLAMINO)BUTANEDIOICACID
ZINC000001655440
2(CARBAMOYLAMINO)BUTANEDIOICACID
923375
MFCD00042822
N(AMINOCARBONYL)ASPARTICACID
N(AMINOCARBONYL)DLASPARTICACID
NCARBAMOYLASPARTICACID
NCARBAMOYLDLASPARTICACID
NCARBAMYLDLASPARTICACID
C(C(C(=O)O)NC(=O)N)C(=O)O
InChI=1SC5H8N2O5c65(12)72(4(10)11)13(8)9h2H1H2(H89)(H1011)(H36712)
BBL003548
Synonyms: 4-amino-5-(2-methylfuran-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1occc1c1nnc(n1N)S
Cc1occc1c1nnc(n1N)S
ZINC06682105
ZINC6682105
160233272
4AMINO3(2METHYLFURAN3YL)1H124TRIAZOLE5THIONE
4AMINO5(2METHYL3FURYL)4H124TRIAZOLE3THIOL
4AMINO5(2METHYLFURAN3YL)124TRIAZOLE3THIOL
4AMINO5(2METHYLFURAN3YL)4H(124)TRIAZOLE3THIOL
4AMINO5(2METHYLFURAN3YL)4H124TRIAZOLE3THIOL
CC1=C(C=CO1)C2=NNC(=S)N2N
InChI=1SC7H8N4OSc145(23124)69107(13)11(6)8h23H8H21H3(H1013)
BBL003549
Synonyms: 4-amino-5-(3-bromophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Brc1cccc(c1)c1nnc(n1N)S
Brc1cccc(c1)c1nnc(n1N)S
ZINC18284543
3H124TRIAZOLE3THIONE4AMINO5(3BROMOPHENYL)24DIHYDRO
4AMINO3(3BROMOPHENYL)1H124TRIAZOLE5THIONE
4AMINO5(3BROMOPHENYL)124TRIAZOLE3THIOL
4AMINO5(3BROMOPHENYL)124TRIAZOLE3THIOLS
4AMINO5(3BROMOPHENYL)24DIHYDRO3H124TRIAZOLE3THIONE
4AMINO5(3BROMOPHENYL)2H124TRIAZOLE3THIONE
4AMINO5(3BROMOPHENYL)4H124TRIAZOLE3THIOL
4AZANYL3(3BROMOPHENYL)1H124TRIAZOLE5THIONE
87239961
C1=CC(=CC(=C1)Br)C2=NNC(=S)N2N
InChI=1SC8H7BrN4Sc963125(46)711128(14)13(7)10h14H10H2(H1214)
BBL003550
Synonyms: 4-(ethylsulfanyl)aniline
Smiles: CCSc1ccc(cc1)N
CCSc1ccc(cc1)N
PETHYLTHIOANILINE
ZINC01604760
ZINC1604760
4(ETHYLSULFANYL)ANILINE
4(ETHYLTHIO)ANILINE
4AMINOPHENYLETHYLSULPHIDE
4ETHYLSULFANYLANILINE
4ETHYLTHIOANILINE
4ETHYLTHIOPHENYLAMINE
CCSC1=CC=C(C=C1)N
InChI=1SC8H11NSc12108537(9)468h36H29H21H3
BBL003551
Synonyms: 5-(3,5-dichlorophenyl)furan-2-carboxylicacid
Smiles: Clc1cc(Cl)cc(c1)c1ccc(o1)C(=O)O
Clc1cc(Cl)cc(c1)c1ccc(o1)C(=O)O
MFCD02257996
ZINC000000157136
ZINC157136
2FURANCARBOXYLICACID5(35DICHLOROPHENYL)
5(35DICHLOROPHENYL)2FURANCARBOXYLICACID
5(35DICHLOROPHENYL)FURAN2CARBOXYLICACID
C1=C(OC(=C1)C(=O)O)C2=CC(=CC(=C2)Cl)Cl
InChI=1SC11H6Cl2O3c12736(48(13)57)91210(169)11(14)15h15H(H1415)
BBL003552
Synonyms: 2-(2,6-dimethylphenoxy)ethanamine
Smiles: NCCOc1c(C)cccc1C
NCCOc1c(C)cccc1C
ZINC4072718
2(2AMINOETHOXY)13DIMETHYLBENZENE
1749468
2(26DIMETHYLPHENOXY)ETHANAMINE
2(26DIMETHYLPHENOXY)ETHYLAMINE
CC1=C(C(=CC=C1)C)OCCN
InChI=1SC10H15NOc184359(2)10(8)127611h35H6711H212H3
BBL003553
Synonyms: 4-amino-5-(naphthalen-1-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Nn1c(nnc1S)Cc1cccc2c1cccc2
Nn1c(nnc1S)Cc1cccc2c1cccc2
ZINC5731747
151297835
3H124TRIAZOLE3THIONE4AMINO24DIHYDRO5(1NAPHTHALENYLMETHYL)
4AMINO3(1NAPHTHALENYLMETHYL)1H124TRIAZOLE5THIONE
4AMINO3(1NAPHTHYLMETHYL)1H124TRIAZOLE5THIONE
4AMINO3(NAPHTHALEN1YLMETHYL)1H124TRIAZOLE5THIONE
4AMINO5(NAPHTHALEN1YLMETHYL)124TRIAZOLE3THIOL
4AMINO5(NAPHTHALEN1YLMETHYL)4H124TRIAZOLE3THIOL
4AMINO5(NAPHTHYLMETHYL)124TRIAZOLE3THIOL
4AMINO5NAPHTHALEN1YLMETHYL4H(124)TRIAZOLE3THIOL
4AZANYL3(NAPHTHALEN1YLMETHYL)1H124TRIAZOLE5THIONE
4H(124)TRIAZOLE3THIOL4AMINO5NAPHTHALEN1YLMETHYL
C1=CC=C2C(=C1)C=CC=C2CC3=NNC(=S)N3N
InChI=1SC13H12N4Sc141712(151613(17)18)8106359412711(9)10h17H814H2(H1618)
BBL003554
Synonyms: 3-fluorobenzohydrazide
Smiles: NNC(=O)c1cccc(c1)F
NNC(=O)c1cccc(c1)F
ZINC000000403973
ZINC00403973
ZINC403973
1FLUOROBENZENE3CARBOHYDRAZIDE
MFCD00060561
3FLUOROBENZENECARBOHYDRAZIDE
3FLUOROBENZHYDRAZIDE
3FLUOROBENZOHYDRAZIDE
3FLUOROBENZOICACIDHYDRAZIDE
3FLUOROBENZOICHYDRAZIDE
499558
C1=CC(=CC(=C1)F)C(=O)NN
InChI=1SC7H7FN2Oc863125(46)7(11)109h14H9H2(H1011)
BBL003555
Synonyms: 4-(4-fluorophenyl)-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile
Smiles: N#Cc1c(O)nc(nc1c1ccc(cc1)F)S
N#Cc1c(O)nc(nc1c1ccc(cc1)F)S
ZINC18102324
131364755
4(4FLUOROPHENYL)6HYDROXY2MERCAPTOPYRIMIDINE5CARBONITRILE
4(4FLUOROPHENYL)6HYDROXY2SULFANYLPYRIMIDINE5CARBONITRILE
4(4FLUOROPHENYL)6OXO2SULFANYL16DIHYDROPYRIMIDINE5CARBONITRILE
5PYRIMIDINECARBONITRILE4(4FLUOROPHENYL)6HYDROXY2MERCAPTO
6(4FLUOROPHENYL)4OXO2SULFANYLIDENE1HPYRIMIDINE5CARBONITRILE
C1=CC(=CC=C1C2=C(C(=O)NC(=S)N2)C#N)F
InChI=1SC11H6FN3OSc127316(247)98(513)10(16)1511(17)149h14H(H214151617)
BBL003556
Synonyms: methyl1-[(3-aminophenyl)sulfonyl]prolinate
Smiles: COC(=O)C1CCCN1S(=O)(=O)c1cccc(c1)N
COC(=O)C1CCCN1S(=O)(=O)c1cccc(c1)N
METHYL1((3AMINOPHENYL)SULFONYL)PROLINATE
METHYL1((3AMINOPHENYL)SULFONYL)PYRROLIDINE2CARBOXYLATE
MFCD12033980
ZINC000015108673
ZINC000015108676
1101623124
methyl1(3aminophenyl)sulfonylpyrrolidine2carboxylate
COC(=O)C1CCCN1S(=O)(=O)C2=CC=CC(=C2)N
InChI=1SC12H16N2O4Sc11812(15)1163714(11)19(1617)105249(13)810h245811H36713H21H3
BBL003557
Synonyms: 2-(3-aminophenyl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione
Smiles: Nc1cccc(c1)N1C(=O)C2N(C1=O)CCC2
Nc1cccc(c1)N1C(=O)C2N(C1=O)CCC2
1219335804
2(3AMINOPHENYL)TETRAHYDRO1HPYRROLO(12C)IMIDAZOLE13(2H)DIONE
2(3aminophenyl)5677atetrahydropyrrolo(12c)imidazole13dione
C1CC2C(=O)N(C(=O)N2C1)C3=CC(=CC=C3)N
InChI=1SC12H13N3O2c1383149(78)1511(16)1052614(10)12(15)17h134710H25613H2
BBL003558
Synonyms: 2,2'-{[4-(propan-2-yl)phenyl]methanediyl}bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)
Smiles: CC(c1ccc(cc1)C(C1=C(O)CC(CC1=O)(C)C)C1=C(O)CC(CC1=O)(C)C)C
CC(c1ccc(cc1)C(C1=C(O)CC(CC1=O)(C)C)C1=C(O)CC(CC1=O)(C)C)C
ZINC96186653
22(4ISOPROPYLPHENYLMETHYLENE)BIS(3HYDROXY55DIMETHYLCYCLOHEX2EN1ONE)
22((4(PROPAN2YL)PHENYL)METHANEDIYL)BIS(3HYDROXY55DIMETHYLCYCLOHEX2EN1ONE)
3HYDROXY2((2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)(4PROPAN2YLPHENYL)METHYL)55DIMETHYLCYCLOHEX2EN1ONE
497060614
CC(C)C1=CC=C(C=C1)C(C2=C(CC(CC2=O)(C)C)O)C3=C(CC(CC3=O)(C)C)O
InChI=1SC26H34O4c115(2)167917(10816)22(2318(27)1125(34)1219(23)28)2420(29)1326(56)1421(24)30h71015222729H1114H216H3
BBL003559
Synonyms: (2E)-3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1ccc(cc1)Cl
COc1cc(ccc1OC)C(=O)C=Cc1ccc(cc1)Cl
ZINC04242417
ZINC4242417
(2E)1(34DIMETHOXYPHENYL)3(4CHLOROPHENYL)PROP2EN1ONE
(2E)3(4CHLOROPHENYL)1(34DIMETHOXYPHENYL)PROP2EN1ONE
(E)3(4CHLOROPHENYL)1(34DIMETHOXYPHENYL)PROP2EN1ONE
(E)34DIMETHOXY4CHLOROCHALCONE
1(34DIMETHOXYPHENYL)3(4CHLOROPHENYL)2PROPENE1ONE
3(4CHLOROPHENYL)1(34DIMETHOXYPHENYL)PROP2EN1ONE
53744302
COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl)OC
InChI=1SC17H15ClO3c1201610613(1117(16)212)15(19)95123714(18)8412h311H12H3b95+
BBL003560
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-phenylurea
Smiles: COc1cc(CCNC(=O)Nc2ccccc2)ccc1OC
COc1cc(CCNC(=O)Nc2ccccc2)ccc1OC
ZINC00284763
ZINC284763
((2(34DIMETHOXYPHENYL)ETHYL)AMINO)NBENZAMIDE
1(2(34DIMETHOXYPHENYL)ETHYL)3PHENYLUREA
1(34DIMETHOXYPHENETHYL)3PHENYLUREA
1PHENYL3(34DIMETHOXYPHENETHYL)UREA
3(2(34DIMETHOXYPHENYL)ETHYL)1PHENYLUREA
67616084
COC1=C(C=C(C=C1)CCNC(=O)NC2=CC=CC=C2)OC
InChI=1SC17H20N2O3c121159813(1216(15)222)10111817(20)19146435714h3912H1011H212H3(H2181920)
BBL003561
Synonyms: 2-(pyridin-4-yl)-1H-indene-1,3(2H)-dione
Smiles: O=C1C(c2ccncc2)C(=O)c2c1cccc2
O=C1C(c2ccncc2)C(=O)c2c1cccc2
ZINC100294966
2PYRIDIN4YLINDAN13DIONE
2PYRIDIN4YLINDENE13DIONE
10478996
2(1HPYRIDIN4YLIDENE)INDANE13QUINONE
2(4PYRIDINYL)1HINDENE13(2H)DIONE
2(4PYRIDYL)2HYDROCYCLOPENTA(12A)BENZENE13DIONE
2(4PYRIDYL)INDANE13DIONE
2(4PYRIDYL)INDANE13QUINONE
2(PYRIDIN4YL)1HINDENE13(2H)DIONE
2(PYRIDIN4YL)23DIHYDRO1HINDENE13DIONE
4(23DIHYDRO13DIOXO1HINDENE2YL)PYRIDINE
4(INDANE13DIONYL)PYRIDINE
C1=CC=C2C(=C1)C(=O)C(C2=O)C3=CC=NC=C3
InChI=1SC14H9NO2c161310312411(10)14(17)12(13)95715869h1812H
BBL003562
Synonyms: 1-(3-aminophenyl)-3-methylimidazolidin-2-one
Smiles: Nc1cccc(c1)N1CCN(C1=O)C
Nc1cccc(c1)N1CCN(C1=O)C
ZINC02559711
ZINC2559711
1(3AMINOPHENYL)3METHYL2IMIDAZOLIDINONE
1(3AMINOPHENYL)3METHYLIMIDAZOLIDIN2ONE
517918820
CN1CCN(C1=O)C2=CC(=CC=C2)N
InChI=1SC10H13N3Oc1125613(10(12)14)94238(11)79h247H5611H21H3
BBL003563
Synonyms: 8-methoxy-2-methylquinolin-5-amine
Smiles: COc1ccc(c2c1nc(C)cc2)N
COc1ccc(c2c1nc(C)cc2)N
ZINC19092751
2METHYL8METHOXYQUINOLINE5AMINE
8METHOXY2METHYL5QUINOLINAMINE
8METHOXY2METHYL5QUINOLINAMINE95
8METHOXY2METHYL5QUINOLINYLAMINE
8METHOXY2METHYL5QUINOLYLAMINE
8METHOXY2METHYLQUINOLIN5AMINE
CC1=NC2=C(C=CC(=C2C=C1)N)OC
InChI=1SC11H12N2Oc173489(12)5610(142)11(8)137h36H12H212H3
BBL003564
Synonyms: 2-[(2,3-dimethylphenyl)amino]benzoicacid
Smiles: OC(=O)c1ccccc1Nc1cccc(c1C)C
OC(=O)c1ccccc1Nc1cccc(c1C)C
PARKEDAVISBRANDOFMEFENAMICACID
PFIZERBRANDOFMEFENAMICACID
PHARMASCIENCEBRANDOFMEFENAMICACID
PINEWOODBRANDOFMEFENAMICACID
PMSMEFENAMICACID
ROWABRANDOFMEFENAMICACID
WARNERLAMBERTBRANDOFMEFENAMICACID
ZINC000000020241
ZINC20241
2(23DIMETHYLPHENYLAMINO)BENZOICACID
2(23DIMETHYLPHENYLAMINO)BENZOICACID(MEFENAMICACID)
2(23XYLIDINO)BENZOICACID
2DIPHENYLAMINECARBOXYLICACID23DIMETHYL
2DIPHENYLAMINECARBOXYLICACID3DIMETHYL
61687
ACIDEMEFENAMIQUE
ACIDEMEFENAMIQUE(FRENCH)
ACIDEMEFENAMIQUE(INNFRENCH)
ACIDMEFENAMIC
ACIDMEFENAMINIC
ACIDOMEFENAMICO
ACIDUMMEFENAMICUM
ACIDUMMEFENAMICUM(INNLATIN)
ACMEFENAMICO
ANTHRANILICACID3XYLYL
ANTHRANILICACIDN(23XYLYL)
ANTHRANILICACIDN23XYLYL
ANTIGENBRANDOFMEFENAMICACID
APOMEFENAMIC
APOTEXBRANDOFMEFENAMICACID
APSBRANDOFMEFENAMICACID
ASHBOURNEBRANDOFMEFENAMICACID
MEFENACID
MEFENAMATE
MEFENAMIC
MEFENAMIC250
MEFENAMICACID
MEFENAMICACID(JP15USPINN)
MEFENAMICACID(JP16USPINN)
MEFENAMICACID(USANINNBANJAN)
MEFENAMICACID(USANUSPINNBANJAN)
MEFENAMINICACID
MEFENAMINSAEURE
MEFENAMINSAURE
MEPHENAMICACID
MEPHENAMINICACID
METHENAMICACID
MFCD00051721
N(23DIMETHYLPHENYL)ANTHRANILICACID
N(23XYLYL)2AMINOBENZOICACID
N(23XYLYL)ANTHRANILICACID
N23XYLYLANTHRANILICACID
NAMPHEN
NOVOMEFENAMICCAPSULES250MG
NUMEFENAMIC
NUMEFENAMIC250MG
NUPHARMBRANDOFMEFENAMICACID
CHEMIDEXBRANDOFMEFENAMICACID
CLONMELBRANDOFMEFENAMICACID
DOMMEFENAMICACID
ELANBRANDOFMEFENAMICACID
FARMASIERRABRANDOFMEFENAMICACID
FIRSTHORIZONBRANDOFMEFENAMICACID
GODECKEBRANDOFMEFENAMICACID
2((23DIMETHYLPHENYL)AMINO)BENZOICACID
2(23DIMETHYLANILINO)BENZOICACID
BENZOICACID2((23DIMETHYLPHENYL)AMINO)
BENZOICACID2(23DIMETHYLPHENYL)AMINO
BENZOICACID3DIMETHYLPHENYL)AMINO)
CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)C
InChI=1SC15H15NO2c11065913(11(10)2)1614843712(14)15(17)18h3916H12H3(H1718)
BBL003565
Synonyms: pyridine-3-carbohydrazide
Smiles: NNC(=O)c1cccnc1
NNC(=O)c1cccnc1
PYRIDINE3CARBOHYDRAZIDE
PYRIDINE3CARBOXYLICACIDHYDRAZIDE
ZINC000000152498
3PYRIDINECARBOXYLICACIDHYDRAZIDE
3PYRIDINECARBOXYLICACIDHYDRAZIDE(9CI)
3PYRIDINECARBOXYLICHYDRAZIDE
HYDRAZINENICOTINOYL
(3PYRIDYLCARBONYL)HYDRAZINE
3PYRIDINECARBOHYDRAZIDE
ZINC00152498
ZINC152498
3PYRIDOYLHYDRAZINE
3PYRIDYLCARBONYLHYDRAZINE
553537
MFCD00006383
NICOTINICACIDHYDRAZIDE
NICOTINICACIDHYDRAZIDE97
NICOTINICHYDRAZIDE
NICOTINICHYDRAZINE
NICOTINOHYDRAZIDE
NICOTINOYLHYDRAZIDE
NICOTINOYLHYDRAZINE
NICOTINYLHYDRAZIDE
NICOTINYLHYDRAZINE
C1=CC(=CN=C1)C(=O)NN
InChI=1SC6H7N3Oc796(10)5213845h14H7H2(H910)
BBL003566
Synonyms: 3-(2-methylphenyl)-1H-pyrazol-5-amine
Smiles: Cc1ccccc1c1n[nH]c(c1)N
Cc1ccccc1c1n(nH)c(c1)N
ZINC04234695
ZINC4234695
3(2METHYLPHENYL)1HPYRAZOL5AMINE
3(2METHYLPHENYL)PYRAZOLE5YLAMINE
3AMINO5(2METHYLPHENYL)1HPYRAZOLE
3AMINO5(2METHYLPHENYL)PYRAZOLE
3AMINO5OTOLYLPYRAZOLE
3OTOLYL1HPYRAZOL5AMINE
5(2METHYLPHENYL)1HPYRAZOL3AMINE
5(OTOLYL)1HPYRAZOL3AMINE
57860421
5OTOLYL1HPYRAZOL3AMINE
5OTOLYL1HPYRAZOL3YLAMINE
5OTOLYL2HPYRAZOL3YLAMINE
CC1=CC=CC=C1C2=CC(=NN2)N
InChI=1SC10H11N3c1742358(7)9610(11)13129h26H1H3(H3111213)
BBL003567
Synonyms: 2-(2-methoxyphenoxy)benzoicacid
Smiles: COc1ccccc1Oc1ccccc1C(=O)O
COc1ccccc1Oc1ccccc1C(=O)O
ZINC190807
2(2METHOXYPHENOXY)BENZOICACID
21905737
BENZOICACID2(2METHOXYPHENOXY)
BENZOICACIDO(OMETHOXYPHENOXY)
COC1=CC=CC=C1OC2=CC=CC=C2C(=O)O
InChI=1SC14H12O4c11712845913(12)1811732610(11)14(15)16h29H1H3(H1516)
BBL003568
Synonyms: 2,2'-piperazine-1,4-diyldiaceticacid
Smiles: OC(=O)CN1CCN(CC1)CC(=O)O
OC(=O)CN1CCN(CC1)CC(=O)O
PIPERAZINE14DIACETICACID
ZINC000019366645
ZINC19366645
MFCD03444539
NNPIPERAZINEDIACETICACID
(4(CARBOXYMETHYL)PIPERAZIN1YL)ACETICACID
(4CARBOXYMETHYLPIPERAZIN1YL)ACETICACID
14PIPERAZINEDIACETICACID
2(4(CARBOXYMETHYL)PIPERAZIN1YL)ACETICACID
2(4(CARBOXYMETHYL)PIPERAZINYL)ACETICACID
22PIPERAZINE14DIYLDIACETICACID
5430784
C1CN(CCN1CC(=O)O)CC(=O)O
InChI=1SC8H14N2O4c117(12)591210(439)68(13)14h16H2(H1112)(H1314)
BBL003569
Synonyms: 4-amino-2-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenol
Smiles: Nc1ccc(c(c1)c1nc2c(o1)cccn2)O
Nc1ccc(c(c1)c1nc2c(o1)cccn2)O
4amino2((13)oxazolo(45b)pyridin2yl)phenol
MFCD03175935
ZINC000000529855
443636202
BBL003570
Synonyms: {5-[3,5-bis(trifluoromethyl)phenyl]furan-2-yl}methanol
Smiles: OCc1ccc(o1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
OCc1ccc(o1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
ZINC000000138395
ZINC00138395
ZINC138395
MFCD00052573
(5(35BIS(TRIFLUOROMETHYL)PHENYL)2FURYL)METHAN1OL
(5(35BIS(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHANOL
(5(35BISTRIFLUOROMETHYLPHENYL)FURAN2YL)METHANOL
(5(35DI(TRIFLUOROMETHYL)PHENYL)2FURYL)METHANOL
(5(35DIPHENYL)2FURYL)METHANOL
2FURANMETHANOL5(35BIS(TRIFLUOROMETHYL)PHENYL)
424803190
5(35BIS(TRIFLUOROMETHYL)PHENYL)FURAN2METHANOL
5(35DI(TRIFLUOROMETHYL)PHENYL)2FURYLMETHANOL
C1=C(OC(=C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)CO
InChI=1SC13H8F6O2c1412(1516)837(49(58)13(1718)19)112110(620)2111h1520H6H2
BBL003571
Synonyms: 3-ethoxy-2-hydroxy-5-nitrobenzaldehyde
Smiles: CCOc1cc(cc(c1O)C=O)[N+](=O)[O-]
CCOc1cc(cc(c1O)C=O)(N+)(=O)(O)
150655064
3ETHOXY2HYDROXY5NITROBENZALDEHYDE
MFCD00047741
ZINC000049997101
ZINC49997101
BENZALDEHYDE3ETHOXY2HYDROXY5NITRO
CCOC1=C(C(=CC(=C1)(N+)(=O)(O))C=O)O
InChI=1SC9H9NO5c1215847(10(13)14)36(511)9(8)12h3512H2H21H3
BBL003572
Synonyms: N-(3-aminophenyl)morpholine-4-carboxamide
Smiles: Nc1cccc(c1)NC(=O)N1CCOCC1
Nc1cccc(c1)NC(=O)N1CCOCC1
ZINC000019231850
ZINC19231850
MFCD11114809
N(3AMINOPHENYL)MORPHOLIN4YLCARBOXAMIDE
N(3AMINOPHENYL)MORPHOLINE4CARBOXAMIDE
4MORPHOLINECARBOXAMIDEN(3AMINOPHENYL)
919833300
C1COCCN1C(=O)NC2=CC=CC(=C2)N
InChI=1SC11H15N3O2c12921310(89)1311(15)1446167514h138H4712H2(H1315)
BBL003573
Synonyms: octahydro-2H-1,4-benzoxazine
Smiles: C1CCC2C(C1)OCCN2
C1CCC2C(C1)OCCN2
2H14BENZOXAZINEOCTAHYDRO
2OXA5AZABICYCLO(440)DECANE
52769116
OCTAHYDRO2H14BENZOXAZINE
OCTAHYDRO2H14BENZOXAZINEHYDROBROMIDE
OCTAHYDRO2HBENZO(B)(14)OXAZINE
OCTAHYDROBENZO(14)OXAZINE
344a56788aoctahydro2Hbenzo(b)(14)oxazine
C1CCC2C(C1)NCCO2
InChI=1SC8H15NOc12487(31)956108h79H16H2
BBL003574
Synonyms: 4-[(2-bromobenzyl)oxy]-2-[(2-bromophenoxy)methyl]benzaldehyde
Smiles: O=Cc1ccc(cc1COc1ccccc1Br)OCc1ccccc1Br
O=Cc1ccc(cc1COc1ccccc1Br)OCc1ccccc1Br
4((2BROMOBENZYL)OXY)2((2BROMOPHENOXY)METHYL)BENZALDEHYDE
4((2BROMOPHENYL)METHOXY)2((2BROMOPHENOXY)METHYL)BENZALDEHYDE
1172912832
MFCD12972338
ZINC000030834189
ZINC30834189
2((2bromophenoxy)methyl)4((2bromophenyl)methoxy)benzaldehyde
C1=CC=C(C(=C1)COC2=CC(=C(C=C2)C=O)COC3=CC=CC=C3Br)Br
InChI=1SC21H16Br2O3c2219621516(19)13251810915(1224)17(1118)142621843720(21)23h112H1314H2
BBL003575
Synonyms: 2-(2-hydroxyphenyl)acetamide
Smiles: NC(=O)Cc1ccccc1O
NC(=O)Cc1ccccc1O
ZINC000000397417
ZINC00397417
ZINC397417
2HYDROXYBENZENEACETAMIDE
(2HYDROXYPHENYL)ACETICACIDAMIDE
2(2HYDROXYPHENYL)ACETAMIDE
22446408
2HYDROXYPHENYLACETAMIDE
BENZENEACETAMIDE2HYDROXY
MFCD00025519
C1=CC=C(C(=C1)CC(=O)N)O
InChI=1SC8H9NO2c98(11)5631247(6)10h1410H5H2(H2911)
BBL003576
Synonyms: (2E)-3-{2-methoxy-5-[(methoxycarbonyl)oxy]phenyl}prop-2-enoicacid
Smiles: COC(=O)Oc1ccc(c(c1)/C=C/C(=O)O)OC
COC(=O)Oc1ccc(c(c1)C=CC(=O)O)OC
MFCD13372578
ZINC000030834349
ZINC30834349
(2E)3(2METHOXY5((METHOXYCARBONYL)OXY)PHENYL)ACRYLICACID
(2E)3(2METHOXY5((METHOXYCARBONYL)OXY)PHENYL)PROP2ENOICACID
(2E)3(2METHOXY5METHOXYCARBONYLOXYPHENYL)PROP2ENOICACID
1173471710
(E)3(2methoxy5methoxycarbonyloxyphenyl)prop2enoicacid
COC1=C(C=C(C=C1)OC(=O)OC)C=CC(=O)O
InChI=1SC12H12O6c11610549(1812(15)172)78(10)3611(13)14h37H12H3(H1314)b63+
BBL003577
Synonyms: 1,1'-(4-aminobenzene-1,3-diyl)dipyrrolidin-2-one
Smiles: O=C1CCCN1c1ccc(c(c1)N1CCCC1=O)N
O=C1CCCN1c1ccc(c(c1)N1CCCC1=O)N
ZINC30834327
1(4AMINO3(2OXOPYRROLIDINYL)PHENYL)PYRROLIDIN2ONE
11(4AMINO13PHENYLENE)DIPYRROLIDIN2ONE
11(4AMINOBENZENE13DIYL)DIPYRROLIDIN2ONE
1170504434
1(4amino3(2oxopyrrolidin1yl)phenyl)pyrrolidin2one
C1CC(=O)N(C1)C2=CC(=C(C=C2)N)N3CCCC3=O
InChI=1SC14H17N3O2c15116510(1671313(16)18)912(11)1782414(17)19h569H147815H2
BBL003578
Synonyms: 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)methanamine
Smiles: NCC1NCCc2c1cccc2
NCC1NCCc2c1cccc2
1(1234tetrahydroisoquinolin1yl)methanamine
84500709
ZINC000019798135
ZINC000019798138
MFCD00600390
1234tetrahydroisoquinolin1ylmethanamine
C1CNC(C2=CC=CC=C21)CN
InChI=1SC10H14N2c11710942138(9)561210h141012H5711H2
BBL003579
Synonyms: 4-(1,3-dioxotetrahydro-1H-pyrrolo[1,2-c]imidazol-2(3H)-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)C2N(C1=O)CCC2
OC(=O)c1ccc(cc1)N1C(=O)C2N(C1=O)CCC2
ZINC000036075295
ZINC000036075296
MFCD13372579
1219375491
4(13DIOXOTETRAHYDRO1HPYRROLO(12C)IMIDAZOL2(3H)YL)BENZOICACID
4(13dioxo5677atetrahydropyrrolo(12c)imidazol2yl)benzoicacid
C1CC2C(=O)N(C(=O)N2C1)C3=CC=C(C=C3)C(=O)O
InChI=1SC13H12N2O4c16111021714(10)13(19)15(11)9538(469)12(17)18h3610H127H2(H1718)
BBL003580
Synonyms: 2-[4-(methylsulfanyl)phenoxy]ethanamine
Smiles: NCCOc1ccc(cc1)SC
NCCOc1ccc(cc1)SC
ZINC36245284
2(4METHYLSULFANYLPHENOXY)ETHYLAMINE
1203188220
2(4(METHYLSULFANYL)PHENOXY)ETHANAMINE
2(4(METHYLTHIO)PHENOXY)ETHANAMINE
2(4(METHYLTHIO)PHENOXY)ETHYLAMINE
2(4methylsulfanylphenoxy)ethanamine
CSC1=CC=C(C=C1)OCCN
InChI=1SC9H13NOSc1129428(359)117610h25H6710H21H3
BBL003581
Synonyms: N-benzyl-5-methoxy-1H-benzimidazol-2-amine
Smiles: COc1ccc2c(c1)nc([nH]2)NCc1ccccc1
COc1ccc2c(c1)nc((nH)2)NCc1ccccc1
(5METHOXYBENZIMIDAZOL2YL)BENZYLAMINE
233605862
BENZYL(5METHOXY1HBENZOIMIDAZOL2YL)AMINE
MFCD06604089
NBENZYL5METHOXY1H13BENZODIAZOL2AMINE
NBENZYL5METHOXY1HBENZIMIDAZOL2AMINE
NBENZYL5METHOXY3H13BENZODIAZOL2AMINE
NBENZYL6METHOXY1HBENZIMIDAZOL2AMINE
NBENZYL6METHOXY1HBENZIMIDAZOLE2AMINE
ZINC000005908946
ZINC5908946
COC1=CC2=C(C=C1)N=C(N2)NCC3=CC=CC=C3
InChI=1SC15H15N3Oc11912781314(912)1815(1713)1610115324611h29H10H21H3(H2161718)
BBL003582
Synonyms: ethyl5-amino-2,3-dihydro-1H-indole-1-carboxylate
Smiles: CCOC(=O)N1CCc2c1ccc(c2)N
CCOC(=O)N1CCc2c1ccc(c2)N
ETHYL5AMINO23DIHYDRO1HINDOLE1CARBOXYLATE
1021106455
1HINDOLE1CARBOXYLICACID5AMINO23DIHYDROETHYLESTER
ETHYL5AMINOINDOLINE1CARBOXYLATE
ETHYL5AMINOINDOLINECARBOXYLATE
ZINC19874886
ethyl5amino23dihydroindole1carboxylate
CCOC(=O)N1CCC2=C1C=CC(=C2)N
InChI=1SC11H14N2O2c121511(14)1365879(12)3410(8)13h347H25612H21H3
BBL003583
Synonyms: 1-(2-amino-4-methylphenyl)pyrrolidin-2-one
Smiles: Cc1ccc(c(c1)N)N1CCCC1=O
Cc1ccc(c(c1)N)N1CCCC1=O
1(2AMINO4METHYLPHENYL)PYRROLIDIN2ONE
69131722
ZINC36245287
CC1=CC(=C(C=C1)N2CCCC2=O)N
InChI=1SC11H14N2Oc184510(9(12)78)1362311(13)14h457H23612H21H3
BBL003584
Synonyms: 1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
Smiles: NC1CC2C(C1(C)CC2)(C)C
NC1CC2C(C1(C)CC2)(C)C
(177TRIMETHYLBICYCLO(221)HEPT2YL)AMINEHYDROCHLORIDE
(1R2S4R)BORN2YLAMINE
ENDO177TRIMETHYLBICYCLO(221)HEPTAN2AMINE
ENDO2BORNYLAMINE
ISOBORNYLAMINE
(1S2R4S)177TRIMETHYLBICYCLO(221)HEPTAN2AMINE
(R)()BORNYLAMINE
177TRIMETHYLBICYCLO(221)HEPT2YLAMINE
177TRIMETHYLBICYCLO(221)HEPTAN2AMINE
177TRIMETHYLBICYCLO(221)HEPTANEXO2AMINE
2BORNANAMINEENDO
2BORNYLAMINE
464426
477TRIMETHYLBICYCLO(221)HEPTAN3AMINE
BICYCLO(221)HEPTAN2AMINE177TRIMETHYLENDO
BORNYLAMINE
CC1(C2CCC1(C(C2)N)C)C
InChI=1SC10H19Nc19(2)74510(93)8(11)67h78H4611H213H3
BBL003585
Synonyms: 5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1CC(=NN1c1ccc(cc1)[N+](=O)[O-])C
O=C1CC(=NN1c1ccc(cc1)(N+)(=O)(O))C
ZINC4284414
1(4NITROPHENYL)3METHYL5(4H)PYRAZOLONE
24DIHYDRO2(PNITROPHENYL)5METHYL3HPYRAZOL3ONE
24DIHYDRO5METHYL2(4NITROPHENYL)3HPYRAZOL3ONE
2PYRAZOLIN5ONE3METHYL1(PNITROPHENYL)
2PYRAZOLIN5ONE3METHYL1(PNITROPHENYL)(8CI)
3HPYRAZOL3ONE24DIHYDRO5METHYL2(4NITROPHENYL)
3HPYRAZOL3ONE4DIHYDRO5METHYL2(4NITROPHENYL)
3METHYL1(4NITROPHENYL)2PYRAZOLIN5ONE
3METHYL1(4NITROPHENYL)5PYRAZOLONE
5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
5METHYL2(4NITROPHENYL)24DIHYDROPYRAZOL3ONE
5METHYL2(4NITROPHENYL)4HPYRAZOL3ONE
6402091
CC1=NN(C(=O)C1)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC10H9N3O3c17610(14)12(117)8249(538)13(15)16h25H6H21H3
BBL003586
Synonyms: 5,6-dinitro-1,3-benzodioxole
Smiles: [O-][N+](=O)c1cc2OCOc2cc1[N+](=O)[O-]
(O)(N+)(=O)c1cc2OCOc2cc1(N+)(=O)(O)
12DINITRO45METHYLENEDIOXYBENZENE
12METHYLENEDIOXY45DINITROBENZENE
45METHYLENEDIOXY12DINITROBENZENE
56DINITRO13BENZODIOXOLE
56DINITROBENZO(13)DIOXOLE
56DINITROBENZO(D)(13)DIOXOLE
7748596
MFCD04973596
ZINC000020428688
ZINC20428688
C1OC2=C(O1)C=C(C(=C2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC7H4N2O6c108(11)4167(153146)25(4)9(12)13h12H3H2
BBL003587
Synonyms: 2-thioxo-1,2,3,7-tetrahydro-6H-purin-6-one
Smiles: S=c1[nH]c(=O)c2c([nH]1)nc[nH]2
S=c1(nH)c(=O)c2c((nH)1)nc(nH)2
2thioxo1237tetrahydro6Hpurin6one
2THIOXO23DIHYDRO1HPURIN6(7H)ONE
2THIOXO37DIHYDROPURIN6ONE
2THIOXO39DIHYDROPURIN6ONE
6HPURIN6ONE237TETRAHYDRO2THIOXO
6HYDROXY2MERCAPTOPURINE
6HYDROXY2PURINETHIOL
6HYDROXYPURINE2THIOL
2487403
2MERCAPTO19DIHYDRO6HPURIN6ONE
HYPOXANTHINE2MERCAPTO
THIOXANTHIN
XANTHINE2THIO
XANTHINE2THIO(8CI)
XANTHINE2THIO(VAN)
XANTHINE2THIO(VAN)(8CI)
ZINC18127213
2MERCAPTO6HYDROXYPURINE
2MERCAPTO9HPURIN6OL
2MERCAPTOHYPOXANTHINE
2SULFANYL19DIHYDRO6HPURIN6ONE
2SULFANYL9HPURIN6OL
2SULFANYLHYDROPURIN6ONE
2SULFANYLIDENE37DIHYDRO1HPURIN6ONE
2SULFANYLIDENE37DIHYDROPURIN6ONE
2SULFANYLPURIN6OL
2THIO6HYDROXYPURINEHYDRATE98
2THIO6OXOPURINE
2THIO6OXYPURINE
2THIOHYPOXANTHINE
2THIOXANTHENE
2THIOXANTHINE
BBL003588
Synonyms: 2-[(4-chlorophenyl)sulfanyl]propanoicacid
Smiles: CC(C(=O)O)Sc1ccc(cc1)Cl
CC(C(=O)O)Sc1ccc(cc1)Cl
PROPANOICACID2((4CHLOROPHENYL)THIO)
18527123
2((4CHLOROPHENYL)SULFANYL)PROPANOICACID
2((4CHLOROPHENYL)THIO)PROPANOICACID
2(4CHLOROPHENYL)SULFANYLPROPANOICACID
2(4CHLOROPHENYLTHIO)PROPANOICACID
CC(C(=O)O)SC1=CC=C(C=C1)Cl
InChI=1SC9H9ClO2Sc16(9(11)12)138427(10)358h26H1H3(H1112)
BBL003589
Synonyms: 4-chlorobenzohydrazide
Smiles: NNC(=O)c1ccc(cc1)Cl
NNC(=O)c1ccc(cc1)Cl
PCHLOROBENZHYDRAZIDE
PCHLOROBENZOHYDRAZIDE
PCHLOROBENZOICACIDHYDRAZIDE
PCHLOROBENZOICHYDRAZIDE
MFCD00007603
(4CHLOROBENZOYL)HYDRAZINE
(PCHLOROBENZOYL)HYDRAZINE
PCHLOROBENZOYLHYDRAZIDE
PCHLOROBENZOYLHYDRAZINE
ZINC000000154658
ZINC00154658
ZINC154658
4CHLORANYLBENZOHYDRAZIDE
4CHLOROBENZENE1CARBOHYDRAZIDE
4CHLOROBENZENECARBOHYDRAZIDE
4CHLOROBENZHYDRAZIDE
4CHLOROBENZOHYDRAZIDE
4CHLOROBENZOICACIDHYDRAZIDE
4CHLOROBENZOICHYDRAZIDE
4CHLOROBENZOYLHYDRAZIDE
4CHLOROBENZOYLHYDRAZINE
536403
BENZOICACID4CHLOROHYDRAZIDE
BENZOICACID4CHLOROHYDRAZIDE(9CI)
BENZOICACIDPCHLOROHYDRAZIDE
BENZOICACIDPCHLOROHYDRAZIDE(8CI)
BENZOYLHYDRAZINEPCHLORO
C1=CC(=CC=C1C(=O)NN)Cl
InChI=1SC7H7ClN2Oc86315(246)7(11)109h14H9H2(H1011)
BBL003590
Synonyms: 4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline
Smiles: Nc1ccc(cc1)c1nncn1C
Nc1ccc(cc1)c1nncn1C
ZINC04272143
ZINC4272143
3(4AMINOPHENYL)4METHYL4H124TRIAZOLE
4(4METHYL124TRIAZOL3YL)ANILINE
4(4METHYL124TRIAZOL3YL)PHENYLAMINE
4(4METHYL4H124TRIAZOL3YL)ANILINE
690632189
BENZENAMINE4(4METHYL4H124TRIAZOL3YL)
CN1C=NN=C1C2=CC=C(C=C2)N
InChI=1SC9H10N4c113611129(13)7248(10)537h26H10H21H3
BBL003591
Synonyms: 2-(4-propylphenoxy)ethanamine
Smiles: CCCc1ccc(cc1)OCCN
CCCc1ccc(cc1)OCCN
ZINC4227446
(2(4PROPYLPHENOXY)ETHYL)AMINEHYDROCHLORIDE
120351953
2(4PROPYLPHENOXY)ETHANAMINE
2(4PROPYLPHENOXY)ETHYLAMINE
CCCC1=CC=C(C=C1)OCCN
InChI=1SC11H17NOc123104611(7510)139812h47H238912H21H3
BBL003592
Synonyms: 3-(1,3-benzodioxol-5-yl)propanoicacid
Smiles: OC(=O)CCc1ccc2c(c1)OCO2
OC(=O)CCc1ccc2c(c1)OCO2
ZINC31306
13BENZODIOXOLE5PROPANOICACID
13BENZODIOXOLE5PROPIONICACID
2815954
3(13BENZODIOXOL5YL)PROPANOICACID
3(2H13BENZODIOXOL5YL)PROPANOICACID
3(2HBENZO(34D)13DIOXOLEN5YL)PROPANOICACID
3(34METHYLENEDIOXYPHENYL)PROPANOICACID
3(34METHYLENEDIOXYPHENYL)PROPIONICACID
3(BENZO(D)(13)DIOXOL5YL)PROPANOICACID
34(METHYLENEDIOXY)HYDROCINNAMICACID
34METHYLENEDIOXYDIHYDROCINNAMICACID
34METHYLENEDIOXYHYDROCINNAMICACID
3BENZO(13)DIOXOL5YLPROPIONICACID
3BENZO13DIOXOL5YLPROPIONICACID
BENZO13DIOXOLE5PROPIONICACID
BETA(34METHYLENEDIOXYPHENYL)PROPIONICACID
HYDROCINNAMICACID34(METHYLENEDIOXY)
HYDROCINNAMICACID4(METHYLENEDIOXY)
BBL003593
Synonyms: 2-(ethylsulfanyl)aniline
Smiles: CCSc1ccccc1N
CCSc1ccccc1N
ZINC16576888
13920917
2(ETHYLSULFANYL)ANILINE
2(ETHYLTHIO)ANILINE
2AMINOPHENYLETHYLSULPHIDE
2ethylsulfanylaniline
CCSC1=CC=CC=C1N
InChI=1SC8H11NSc1210864357(8)9h36H29H21H3
BBL003594
Synonyms: [(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]aceticacid
Smiles: OC(=O)CSc1nnc(n1c1ccccc1)C
OC(=O)CSc1nnc(n1c1ccccc1)C
ZINC422531
ZINC000000422531
2(5METHYL4PHENYL124TRIAZOL3YLTHIO)ACETICACID
MFCD02227063
((5METHYL4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
((5METHYL4PHENYL4H124TRIAZOL3YL)THIO)ACETICACID
(5METHYL4PHENYL4H(124)TRIAZOL3YLSULFANY
(5METHYL4PHENYL4H(124)TRIAZOL3YLSULFANYL)ACETICACID
2((5METHYL4PHENYL124TRIAZOL3YL)SULFANYL)ACETICACID
2((5METHYL4PHENYL1H124TRIAZOL4IUM3YL)SULFANYL)ACETATE
2((5METHYL4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
2((5METHYL4PHENYL4H124TRIAZOL3YL)THIO)ACETICACID
200815834
CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)O
InChI=1SC11H11N3O2Sc18121311(17710(15)16)14(8)9532469h26H7H21H3(H1516)
BBL003595
Synonyms: 5-(2-methylphenyl)-1,3,4-oxadiazole-2-thiol
Smiles: Sc1nnc(o1)c1ccccc1C
Sc1nnc(o1)c1ccccc1C
ZINC1510006
134OXADIAZOLE2(3H)THIONE5(2METHYLPHENYL)
2503664
5(2METHYLPHENYL)134OXADIAZOLE2THIOL
5(2METHYLPHENYL)134OXADIAZOLINE2THIONE
5(2METHYLPHENYL)23DIHYDRO134OXADIAZOLE2THIONE
5(2METHYLPHENYL)3H134OXADIAZOLE2THIONE
5(OTOLYL)134OXADIAZOLE2THIOL
5(OTOLYL)3H134OXADIAZOLE2THIONE
5OTOLYL3H(134)OXADIAZOLE2THIONE
CC1=CC=CC=C1C2=NNC(=S)O2
InChI=1SC9H8N2OSc1642357(6)810119(13)128h25H1H3(H1113)
BBL003596
Synonyms: 6-methyl-1,3-benzodioxol-5-amine
Smiles: Nc1cc2OCOc2cc1C
Nc1cc2OCOc2cc1C
ZINC16284329
(6METHYL13BENZODIOXOL5YL)AMINE
(34METHYLENEDIOXY)6METHYLANILINE
13BENZODIOXOL5AMINE6METHYL
62052497
6METHYL13BENZODIOXOL5AMINE
6METHYL2H13BENZODIOXOL5AMINE
6METHYL2HBENZO(D)13DIOXOLENE5YLAMINE
6METHYLBENZO(D)(13)DIOXOL5AMINE
CC1=CC2=C(C=C1N)OCO2
InChI=1SC8H9NO2c15278(36(5)9)114107h23H49H21H3
BBL003597
Synonyms: 1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-amine
Smiles: Cc1ccc(cc1)n1ncc(c1N)c1ccccc1
Cc1ccc(cc1)n1ncc(c1N)c1ccccc1
ZINC08569816
ZINC8569816
1(4METHYLPHENYL)4PHENYL1HPYRAZOL5AMINE
4PHENYL1(PTOLYL)1HPYRAZOL5AMINE
895011479
2(4methylphenyl)4phenylpyrazol3amine
CC1=CC=C(C=C1)N2C(=C(C=N2)C3=CC=CC=C3)N
InChI=1SC16H15N3c1127914(10812)1916(17)15(111819)135324613h211H17H21H3
BBL003598
Synonyms: 2-(chloromethyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Smiles: COc1cc(cc(c1OC)OC)c1nnc(o1)CCl
COc1cc(cc(c1OC)OC)c1nnc(o1)CCl
2(CHLOROMETHYL)5(345TRIMETHOXYPHENYL)134OXADIAZOLE
2CHLOROMETHYL5(345TRIMETHOXYPHENYL)(134)OXADIAZOLE
5(5(CHLOROMETHYL)(134OXADIAZOL2YL))123TRIMETHOXYBENZENE
50677297
MFCD03988536
ZINC000001431615
ZINC01431615
ZINC1431615
COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)CCl
InChI=1SC12H13ClN2O4c116847(59(172)11(8)183)12151410(613)1912h45H6H213H3
BBL003599
Synonyms: 1-(3-chlorophenyl)-3-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylicacid
Smiles: Clc1cccc(c1)n1nc(c2c1sc(c2)C(=O)O)C
Clc1cccc(c1)n1nc(c2c1sc(c2)C(=O)O)C
ZINC000003246428
ZINC3246428
MFCD03980972
1(3CHLOROPHENYL)3METHYL1HTHIENO(23C)PYRAZOLE5CARBOXYLICACID
1(3CHLOROPHENYL)3METHYLTHIENO(23C)PYRAZOLE5CARBOXYLICACID
1(3CHLOROPHENYL)3METHYLTHIOPHENO(32D)PYRAZOLE5CARBOXYLICACID
565171075
CC1=NN(C2=C1C=C(S2)C(=O)O)C3=CC(=CC=C3)Cl
InChI=1SC13H9ClN2O2Sc1710611(13(17)18)1912(10)16(157)94238(14)59h26H1H3(H1718)
BBL003600
Synonyms: 2-chloro-1-(5-nitro-2,3-dihydro-1H-indol-1-yl)ethanone
Smiles: ClCC(=O)N1CCc2c1ccc(c2)[N+](=O)[O-]
ClCC(=O)N1CCc2c1ccc(c2)(N+)(=O)(O)
1(CHLOROACETYL)5NITROINDOLINE
2CHLORO1(5NITRO23DIHYDRO1HINDOL1YL)ETHANONE
2CHLORO1(5NITROINDOLIN1YL)ETHANONE
2CHLORO1(5NITROINDOLINYL)ETHAN1ONE
87866113
MFCD09040374
ZINC000008981485
ZINC08981485
ZINC8981485
2chloro1(5nitro23dihydroindol1yl)ethanone
C1CN(C2=C1C=C(C=C2)(N+)(=O)(O))C(=O)CCl
InChI=1SC10H9ClN2O3c11610(14)1243758(13(15)16)129(7)12h125H346H2
BBL003601
Synonyms: 3-(3-aminophenyl)-1,3-oxazolidin-2-one
Smiles: Nc1cccc(c1)N1CCOC1=O
Nc1cccc(c1)N1CCOC1=O
ZINC12540152
3(3AMINOPHENYL)13OXAZOLIDIN2ONE
3(3AMINOPHENYL)13OXAZOLIDIN2ONE95
3(3AMINOPHENYL)OXAZOLIDIN2ONE
34232434
C1COC(=O)N1C2=CC(=CC=C2)N
InChI=1SC9H10N2O2c1072138(67)1145139(11)12h136H4510H2
BBL003602
Synonyms: 2-(1,3-benzoxazol-2-ylsulfanyl)acetohydrazide
Smiles: NNC(=O)CSc1nc2c(o1)cccc2
NNC(=O)CSc1nc2c(o1)cccc2
ZINC00197016
ZINC197016
(BENZOOXAZOL2YLSULFANYL)ACETICACIDHYDRAZIDE
113546637
2(13BENZOXAZOL2YLSULFANYL)ACETOHYDRAZIDE
2(BENZO(D)OXAZOL2YLTHIO)ACETOHYDRAZIDE
2BENZOXAZOL2YLTHIOACETOHYDRAZIDE
ACETICACID2(2BENZOXAZOLYLTHIO)HYDRAZIDE
C1=CC=C2C(=C1)N=C(O2)SCC(=O)NN
InChI=1SC9H9N3O2Sc10128(13)515911631247(6)149h14H510H2(H1213)
BBL003603
Synonyms: 3-(3-aminophenyl)imidazolidine-2,4-dione
Smiles: Nc1cccc(c1)N1C(=O)CNC1=O
Nc1cccc(c1)N1C(=O)CNC1=O
ZINC000019413991
ZINC19413991
MFCD09812065
3(3AMINOPHENYL)13DIAZOLIDINE24DIONE
3(3AMINOPHENYL)24IMIDAZOLIDINEDIONE
3(3AMINOPHENYL)IMIDAZOLIDINE24DIONE
702638037
C1C(=O)N(C(=O)N1)C2=CC(=CC=C2)N
InChI=1SC9H9N3O2c1062137(46)128(13)5119(12)14h14H510H2(H1114)
BBL003604
Synonyms: 2-(chloromethyl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: ClCc1cc(=O)n2c(n1)c(C)ccc2
ClCc1cc(=O)n2c(n1)c(C)ccc2
ZINC3338680
2(CHLOROMETHYL)9METHYL4HPYRIDO(12A)PYRIMIDIN4ONE
2(CHLOROMETHYL)9METHYL5HYDROPYRIDINO(12A)PYRIMIDIN4ONE
2(CHLOROMETHYL)9METHYLPYRIDO(12A)PYRIMIDIN4ONE
796067442
CC1=CC=CN2C1=NC(=CC2=O)CCl
InChI=1SC10H9ClN2Oc17324139(14)58(611)1210(7)13h25H6H21H3
BBL003605
Synonyms: 2-(naphthalen-1-yloxy)ethanamine
Smiles: NCCOc1cccc2c1cccc2
NCCOc1cccc2c1cccc2
ZINC000005876462
ZINC5876462
MFCD02598964
(2(1NAPHTHYLOXY)ETHYL)AMINEHYDROCHLORIDE
2(1NAPHTHYLOXY)ETHANAMINE
2(NAPHTHALEN1YLOXY)ETHANAMINE
2(NAPHTHALEN1YLOXY)ETHYLAMINE
2NAPHTHYLOXYETHYLAMINE
50882683
2naphthalen1yloxyethanamine
C1=CC=C2C(=C1)C=CC=C2OCCN
InChI=1SC12H13NOc1389141273510412611(10)12h17H8913H2
BBL003606
Synonyms: 5,6-dimethyl-1H-benzimidazol-7-amine
Smiles: Cc1cc2nc[nH]c2c(c1C)N
Cc1cc2nc(nH)c2c(c1C)N
21472093
56DIMETHYL1H13BENZODIAZOL4AMINE
56DIMETHYL1HBENZIMIDAZOL7AMINE
56DIMETHYL1HBENZIMIDAZOL7AMINEDIHYDROCHLORIDE
56DIMETHYL1HBENZO(D)IMIDAZOL4AMINE
56DIMETHYL1HBENZO(D)IMIDAZOL7AMINE
56DIMETHYLBENZIMIDAZOLE7YLAMINE
BENZIMIDAZOLE4AMINO56DIMETHYL
MFCD13370834
ZINC000036245276
ZINC36245276
56dimethyl1Hbenzimidazol4amine
CC1=CC2=C(C(=C1C)N)N=CN2
InChI=1SC9H11N3c15379(124117)8(10)6(5)2h34H10H212H3(H1112)
BBL003607
Synonyms: 3-(propylsulfanyl)-1H-1,2,4-triazol-5-amine
Smiles: CCCSc1n[nH]c(n1)N
CCCSc1n(nH)c(n1)N
MFCD01420307
ZINC000002211935
ZINC02211935
ZINC2211935
3(PROPYLSULFANYL)1H124TRIAZOL5AMINE
3(PROPYLTHIO)1H124TRIAZOL5AMINE
3(PROPYLTHIO)1H124TRIAZOL5AMINE95
3PROPYLSULFANYL1H124TRIAZOL5AMINE
51493175
5PROPYLSULFANYL2H(124)TRIAZOL3YLAMINE
5PROPYLTHIO4H124TRIAZOLE3YLAMINE
CCCSC1=NNC(=N1)N
InChI=1SC5H10N4Sc12310574(6)895h23H21H3(H36789)
BBL003608
Synonyms: 1-(7-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
Smiles: Cc1c(cnc2n1ncn2)C(=O)C
Cc1c(cnc2n1ncn2)C(=O)C
ZINC01393355
ZINC1393355
1(7METHYL(124)TRIAZOLO(15A)PYRIMIDIN6YL)1ETHANONE
1(7METHYL(124)TRIAZOLO(15A)PYRIMIDIN6YL)ETHANONE
1ETHANONE1(7METHYL(124)TRIAZOLO(15A)PYRIMIDIN6YL)
320416908
6ACETYL7METHYL8HYDRO124TRIAZOLO(15A)PYRIMIDINE
CC1=C(C=NC2=NC=NN12)C(=O)C
InChI=1SC8H8N4Oc157(6(2)13)3981041112(5)8h34H12H3
BBL003609
Synonyms: 2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-amine
Smiles: Nc1c2CCCCc2nc2c1CCC2
Nc1c2CCCCc2nc2c1CCC2
235678hexahydro1Hcyclopenta(b)quinolin9amine
62732449
AMIRIDINE
ZINC000006780651
ZINC6780651
IPIDACRINE
MFCD00618424
1H2H3H5H6H7H8HCYCLOPENTA(B)QUINOLIN9AMINE
C1CCC2=C(C1)C(=C3CCCC3=N2)N
InChI=1SC12H16N2c13128412610(8)14117359(11)12h17H2(H21314)
BBL003610
Synonyms: 1-(2,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
Smiles: Cc1nn2c(n1)ncc(c2C)C(=O)C
Cc1nn2c(n1)ncc(c2C)C(=O)C
ZINC02241335
ZINC2241335
1(27DIMETHYL(124)TRIAZOLO(15A)PYRIMIDIN6YL)ETHANONE
1ETHANONE1(27DIMETHYL(124)TRIAZOLO(15A)PYRIMIDIN6YL)
6ACETYL27DIMETHYL8HYDRO124TRIAZOLO(15A)PYRIMIDINE
727997388
CC1=C(C=NC2=NC(=NN12)C)C(=O)C
InChI=1SC9H10N4Oc158(6(2)14)4109117(3)1213(5)9h4H13H3
BBL003611
Synonyms: 1,4-dimethoxybenzene
Smiles: COc1ccc(cc1)OC
COc1ccc(cc1)OC
DIMETHYLETHERHYDROCHINONU
DIMETHYLETHERHYDROQUINONE
DIMETHYLHYDROQUINONE
DIMETHYLHYDROQUINONEETHER
DIMETHYLHYDROQUINONEHYDROQUINONEDIMETHYLETHER
HYDROQUINONEDIMETHYLETHER
150787
2BENZIMIDAZOLINONE13BIS(HYDROXYMETHYL)
QUINOLDIMETHYLETHER
ZINC00388747
ZINC388747
2BENZIMIDAZOLINONE3BIS(HYDROXYMETHYL)
4METHOXYANISOLE
4METHOXYANISOLEANISOLEPMETHOXY
4METHOXYPHENOLMETHYLETHER
ANISOLEPMETHOXY
BENZENE14DIMETHOXY
BENZENEPDIMETHOXY
METHYL4METHOXYPHENYLETHER
METHYLPMETHOXYPHENYLETHER
PDIMETHOXYBENZENE
PMETHOXYANISOLE
14DIMETHOXYBENZEN
14DIMETHOXYBENZENE
14DIMETHOXYBENZOL
COC1=CC=C(C=C1)OC
InChI=1SC8H10O2c197358(102)647h36H12H3
BBL003612
Synonyms: (2E)-1-(4-chlorophenyl)-3-phenylprop-2-en-1-one
Smiles: Clc1ccc(cc1)C(=O)/C=C/c1ccccc1
Clc1ccc(cc1)C(=O)C=Cc1ccccc1
CHALCONE4CHLORO
KETONEPCHLOROPHENYLSTYRYL
PROPENONE1(4CHLOROPHENYL)3PHENYL
ZINC03894724
ZINC3894724
(2E)1(4CHLOROPHENYL)3PHENYLPROP2EN1ONE
(E)1(4CHLOROPHENYL)3PHENYLPROP2EN1ONE
(E)4CHLOROCHALCONE
1(4CHLOROPHENYL)3PHENYL2PROPEN1ONE
1(4CHLOROPHENYL)3PHENYLPROP2EN1ONE
1(4CHLOROPHENYL)3PHENYLPROP2EN1ONE(9)
2PROPEN1ONE1(4CHLOROPHENYL)3PHENYL
4CHLOROCHALCONE
956025
BENZILIDENE4CHLOROACETOPHENONE
BENZYLIDENEPCHLOROACETOPHENONE
C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl
InChI=1SC15H11ClOc16149713(81014)15(17)116124213512h111Hb116+
BBL003613
Synonyms: 1,3-dimethyl-2-thioxoimidazolidin-4-one
Smiles: CN1CC(=O)N(C1=S)C
CN1CC(=O)N(C1=S)C
NNDIMETHYLTHIOHYDANTOIN
ZINC00402566
ZINC402566
13DIMETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
13DIMETHYL2THIOHYDANTOIN
13DIMETHYL2THIOXO13DIAZOLIDIN4ONE
13DIMETHYL2THIOXO4IMIDAZOLIDINONE
13DIMETHYL2THIOXOIMIDAZOLIDIN4ONE
1801623
4IMIDAZOLIDINONE13DIMETHYL2THIOXO
InChI=1SC5H8N2OSc1634(8)7(2)5(6)9h3H212H3
BBL003614
Synonyms: methyl(3-oxodecahydroquinoxalin-2-yl)acetate
Smiles: COC(=O)CC1NC2CCCCC2NC1=O
COC(=O)CC1NC2CCCCC2NC1=O
(3OXODECAHYDROQUINOXALIN2YL)ACETICACIDMETHYLESTER
1008583854
METHYL2(3OXOOCTAHYDRO1HQUINOXALIN2YL)ACETATE
METHYL(3OXODECAHYDRO2QUINOXALINYL)ACETATE
METHYL(3OXODECAHYDROQUINOXALIN2YL)ACETATE
METHYL2(4OXO25DIAZABICYCLO(440)DEC3YL)ACETATE
MFCD03903973
ZINC000013153282
ZINC000053943771
ZINC000239038434
methyl2(3oxo244a56788aoctahydro1Hquinoxalin2yl)acetate
COC(=O)CC1C(=O)NC2CCCCC2N1
InChI=1SC11H18N2O3c11610(14)6911(15)13853247(8)129h7912H26H21H3(H1315)
BBL003615
Synonyms: 4-methyl[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: Nc1nc2nc3c(n2c(n1)C)cccc3
Nc1nc2nc3c(n2c(n1)C)cccc3
ZINC00533776
ZINC533776
135TRIAZINO(12A)BENZIMIDAZOL2AMINE4METHYL
4METHYL(135)TRIAZINO(12A)BENZIMIDAZOL2AMINE
4METHYL135TRIAZINO(12A)BENZIMIDAZOL2AMINE
4METHYL135TRIAZINO(12A)BENZIMIDAZOLE2YLAMINE
4METHYLBENZO(45)IMIDAZO(12A)(135)TRIAZIN2AMINE
4METHYLSTRIAZINO(12A)BENZOIMIDAZOLE2AMINE
78650165
BENZO(45)IMIDAZO(12A)(135)TRIAZINE2AMINO4METHYL
CC1=NC(=NC2=NC3=CC=CC=C3N12)N
InChI=1SC10H9N5c16129(11)141013742358(7)15(6)10h25H1H3(H2111314)
BBL003616
Synonyms: N-benzyl-5-methyl-1H-benzimidazol-2-amine
Smiles: Cc1ccc2c(c1)nc([nH]2)NCc1ccccc1
Cc1ccc2c(c1)nc((nH)2)NCc1ccccc1
(5METHYLBENZIMIDAZOL2YL)BENZYLAMINE
6METHYLN(PHENYLMETHYL)1HBENZIMIDAZOL2AMINE
774560304
BENZYL(5METHYL1HBENZOIMIDAZOL2YL)AMINE
BENZYL(6METHYL1HBENZIMIDAZOL2YL)AMINE
MFCD06591214
NBENZYL5METHYL1HBENZIMIDAZOL2AMINE
NBENZYL5METHYL3H13BENZODIAZOL2AMINE
NBENZYL6METHYL1HBENZIMIDAZOL2AMINE
ZINC000005052450
ZINC5052450
CC1=CC2=C(C=C1)N=C(N2)NCC3=CC=CC=C3
InChI=1SC15H15N3c111781314(911)1815(1713)1610125324612h29H10H21H3(H2161718)
BBL003617
Synonyms: 3,3-dichloro-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(C1(Cl)Cl)cccc2
O=C1Nc2c(C1(Cl)Cl)cccc2
ZINC00118883
ZINC118883
2HINDOL2ONE33DICHLORO13DIHYDRO
33DICHLORO13DIHYDRO2HINDOL2ONE
33DICHLORO13DIHYDROINDOL2ONE
33DICHLORO1HINDOL2ONE
33DICHLOROINDOLIN2ONE
33DICHLOROINDOLINE2ONE
39033459
C1=CC=C2C(=C1)C(C(=O)N2)(Cl)Cl
InChI=1SC8H5Cl2NOc98(10)531246(5)117(8)12h14H(H1112)
BBL003618
Synonyms: 1,5-dimethyl-1H-1,2,3-triazole-4-carboxylicacid
Smiles: OC(=O)c1nnn(c1C)C
OC(=O)c1nnn(c1C)C
ZINC967424
DIMETHYL123TRIAZOLE4CARBOXYLICACID
DIMETHYL1H123TRIAZOLE4CARBOXYLICACID
15DIMETHYL123TRIAZOLE4CARBOXYLICACID
15DIMETHYL1H(123)TRIAZOLE4CARBOXYLICACID
15DIMETHYL1H123TRIAZOLE4CARBOXYLICACID
1H123TRIAZOLE4CARBOXYLICACID15DIMETHYL
329064075
15dimethyltriazole4carboxylicacid
CC1=C(N=NN1C)C(=O)O
InChI=1SC5H7N3O2c134(5(9)10)678(3)2h12H3(H910)
BBL003619
Synonyms: 2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylicacid
Smiles: OC(=O)c1cccnc1Nc1cccc(c1)C(F)(F)F
OC(=O)c1cccnc1Nc1cccc(c1)C(F)(F)F
UPSABRAND1OFNIFLUMICACID
UPSABRAND2OFNIFLUMICACID
UPSACONSEILBRANDOFNIFLUMICACID
UPSAMEDICABRANDOFNIFLUMICACID
ZINC000000125031
ZINC125031
2((3(TRIFLUOROMETHYL)PHENYL)AMINO)PYRIDINE3CARBOXYLICACID
2((3TRIFLUOROMETHYL)PHENYL)AMINO)3PYRIDINECARBOXYLICACID
2((3TRIFLUOROMETHYL)PHENYL)AMINO3PYRIDINECARBOXYLICACID
2((3TRIFLUOROMETHYLPHENYL)AMINO)NICOTINICACID
2(3(TRIFLUOROMETHYL)ANILINO)3PYRIDINECARBOXYLICACID
2(3(TRIFLUOROMETHYL)ANILINO)NICOTINICACID
2(3(TRIFLUOROMETHYL)ANILINO)NICOTINICACID2(AAATRIFLUOROMTOLUIDINO)NICOTINICACID
2(3(TRIFLUOROMETHYL)ANILINO)PYRIDINE3CARBOXYLICACID
2(3(TRIFLUOROMETHYL)PHENYL)AMINONICOTINICACID
2(3TRIFLUOROMETHYLANILINO)NICOTINICACID
2(3TRIFLUOROMETHYLPHENYLAMINO)NICOTINICACID
2(AAATRIFLUOROMTOLUIDINO)NICOTINICACID
2(ALPHAALPHAALPHATRIFLUOROMTOLUIDINO)NICOTINICACID
3PYRIDINECARBOXYLICACID2((3(TRIFLUOROMETHYL)PHENYL)AMINO)
4394007
ACIDENIFLUMIQUE
ACIDENIFLUMIQUE(FRENCH)
ACIDENIFLUMIQUE(INNFRENCH)
ACIDNIFLUMIC
ACIDONIFLUMICO
ACIDUMNIFLUMICUM
ACIDUMNIFLUMICUM(INNLATIN)
AZA2DIMETHYL23(TETRAZOLYL5)6DIPHENYLAMINO
AZA2DIMETHYL23(TETRAZOLYL5)6DIPHENYLAMINO(FRENCH)
MFCD00010569
NICOTINICACID2(ALPHAALPHAALPHATRIFLUOROMTOLUIDINO)
NIFLACTOL
NIFLUMATE
NIFLUMICACID
NIFLUMICACID(HIT16)
NIFLUMICACID(INN)
NIFLUMICACID(INNBANDCF)
NIFLUMICACID(INNDCF)
NIFLUMINICACID
2((3(TRIFLUOROMETHYL)PHENYL)AMINO)3PYRIDINECARBOXYLICACID
2((3(TRIFLUOROMETHYL)PHENYL)AMINO)NICOTINICACID
C1=CC(=CC(=C1)NC2=C(C=CC=N2)C(=O)O)C(F)(F)F
InChI=1SC13H9F3N2O2c1413(1516)83149(78)181110(12(19)20)5261711h17H(H1718)(H1920)
BBL003620
Synonyms: 1,2,3-trimethoxybenzene
Smiles: COc1c(OC)cccc1OC
COc1c(OC)cccc1OC
123TRIMETHOXYBENZENE
13TRIMETHOXYBENZENE
345TRIMETHOXYBENZENE
634366
BENZENE123TRIMETHOXY
BENZENETRIMETHOXY
METHYLSYRINGOL
METHYLSYRINGOL(VAN)
PYROGALLOLTRIMETHYLETHER
TRIMETHOXYBENZENE
TRIOMETHYLPYROGALLOL
ZINC00152503
ZINC152503
COC1=C(C(=CC=C1)OC)OC
InChI=1SC9H12O3c11075468(112)9(7)123h46H13H3
BBL003621
Synonyms: 1,3-benzothiazole-2-thiol
Smiles: Sc1nc2c(s1)cccc2
Sc1nc2c(s1)cccc2
SULFADENE
VULKACITMERCAPTO
VULKACITMERCAPTOC
ZINC18098783
13BENZOTHIAZOLE2THIONE
149304
2(3H)BENZOTHIAZOLETHIONE
23DIHYDRO13BENZOTHIAZOLE2THIONE
2BENZOTHIAZOLETHIOL
2BENZOTHIAZOLINETHIONE
2BENZOTHIAZOLTHIOL
2BENZOTHIAZOLYLMERCAPTAN
2MERCAPTOBENZOTHIAZOL
2MERCAPTOBENZOTHIAZOLE
2MERCAPTOBENZOTHIAZOLE(INLIQUIDMIXTURES)
2MERCAPTOBENZOTHIAZOLYL
2MERCAPTOBENZOTHIOAZOLE
2MERCAPTOBENZTHIAZOLE
2MERCPTOBENZOTHIAZOLE
2MERKAPTOBENZOTIAZOL
2MERKAPTOBENZOTIAZOL(POLISH)
2MERKAPTOBENZTHIAZOL
2SULFANYL13BENZOTHIAZOLE
2THIOBENZOTHIAZOLE
2THIOCARBAMIDOTHIOPHENOL
3H13BENZOTHIAZOLE2THIONE
3HBENZOTHIAZOLE2THIONE
3HYDROBENZOTHIAZOLE2THIONE
13BENZOTHIAZOL2YLHYDROSULFIDE
13BENZOTHIAZOLE2THIOL
ACCELERATORM
ACCELERATORMERCAPTO
BENZO(D)THIAZOLE2(3H)THIONE
BENZO(D)THIAZOLE2THIOL
BENZO(D)THIAZOLE2THIONE
BENZOTHIAZOLE2MERCAPTO
BENZOTHIAZOLE2THIOL
BENZOTHIAZOLE2THIONE
BENZOTHIAZOLEMERCAPTO
BENZOTHIAZOLETHIOL
BENZOTHIAZOLYLMERCAPTAN
MERCAPTO(2)BENZOTHIAZOLE
MERCAPTOBENZOTHIAZOL
MERCAPTOBENZOTHIAZOLE
MERCAPTOBENZOTHIAZOLE(VAN)
MERCAPTOBENZTHIAZOLE
C1=CC=C2C(=C1)NC(=S)S2
InChI=1SC7H5NS2c978531246(5)107h14H(H89)
BBL003622
Synonyms: 5-(4-methylphenyl)-1,3,4-oxadiazole-2-thiol
Smiles: Cc1ccc(cc1)c1nnc(o1)S
Cc1ccc(cc1)c1nnc(o1)S
MFCD02816988
ZINC000000529274
ZINC529274
134OXADIAZOLE2(3H)THIONE5(4METHYLPHENYL)
2MERCAPTO5(4METHYLPHENYL)134OXADIAZOLE
31130151
5(4METHYLPHENYL)134OXADIAZOLE2
5(4METHYLPHENYL)134OXADIAZOLE2(3H)THIONE
5(4METHYLPHENYL)134OXADIAZOLE2THIOL
5(4METHYLPHENYL)134OXADIAZOLINE2THIONE
5(4METHYLPHENYL)3H134OXADIAZOLE2THIONE
5(PTOLYL)134OXADIAZOLE2(3H)THIONE
5(PTOLYL)134OXADIAZOLE2THIOL
5PTOLYL(134)OXADIAZOLE2THIOL
5PTOLYL134OXADIAZOLE2THIOL
5PTOLYL3H(134)OXADIAZOLE2THIONE
CC1=CC=C(C=C1)C2=NNC(=S)O2
InChI=1SC9H8N2OSc16247(536)810119(13)128h25H1H3(H1113)
BBL003623
Synonyms: 4-{[(1-butyl-5-oxopyrrolidin-3-yl)carbonyl]amino}benzoicacid
Smiles: CCCCN1CC(CC1=O)C(=O)Nc1ccc(cc1)C(=O)O
CCCCN1CC(CC1=O)C(=O)Nc1ccc(cc1)C(=O)O
1217862593
4(((1BUTYL5OXOPYRROLIDIN3YL)CARBONYL)AMINO)BENZOICACID
4(1BUTYL5OXOPYRROLIDINE3AMIDO)BENZOICACID
4((1butyl5oxopyrrolidine3carbonyl)amino)benzoicacid
CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)O
InChI=1SC16H20N2O4c1238181012(914(18)19)15(20)17136411(5713)16(21)22h4712H23810H21H3(H1720)(H2122)
BBL003624
Synonyms: 5-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccc(cc1)c1nnc([nH]1)S
Cc1ccc(cc1)c1nnc((nH)1)S
ZINC18143915
3(4METHYLPHENYL)1H124TRIAZOLE5THIOL
3(4METHYLPHENYL)4H124TRIAZOLE5THIOL
3(PMETHYLPHENYL)5MERCAPTO4H124TRIAZOLE
31H124TRIAZOLE5THIOL
3H124TRIAZOLE3THIONE12DIHYDRO5(4METHYLPHENYL)
5(4METHYLPHENYL)12DIHYDRO124TRIAZOLE3THIONE
5(4METHYLPHENYL)1H124TRIAZOLE3THIOL
5(4METHYLPHENYL)4H124TRIAZOLE3THIOL
5PTOLYL24DIHYDRO(124)TRIAZOLE3THIONE
64310345
CC1=CC=C(C=C1)C2=NC(=S)NN2
InChI=1SC9H9N3Sc16247(536)8109(13)12118h25H1H3(H210111213)
BBL003625
Synonyms: 4-(azepan-1-ylsulfonyl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCCC1
OC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCCC1
ZINC3866131
17420687
4(AZAPERHYDROEPINYLSULFONYL)BENZOICACID
4(AZEPAN1YLSULFONYL)BENZOICACID
4(AZEPANE1SULFONYL)BENZOICACID
BENZOICACID4((HEXAHYDRO1HAZEPIN1YL)SULFONYL)
C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O
InChI=1SC13H17NO4Sc1513(16)115712(8611)19(1718)14931241014h58H14910H2(H1516)
BBL003626
Synonyms: ethyl1-acetylpiperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)C
CCOC(=O)C1CCCN(C1)C(=O)C
ETHYL1ACETYLPIPERIDINE3CARBOXYLATE
1ACETYLPIPERIDINE3CARBOXYLICACIDETHYLESTER
2637754
3PIPERIDINECARBOXYLICACID1ACETYLETHYLESTER
MFCD02862111
ZINC000001695137
ZINC000002042066
InChI=1SC10H17NO3c131410(13)954611(79)8(2)12h9H37H212H3
BBL003627
Synonyms: 4-amino-N,N-dibutylbenzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccc(cc1)N)CCCC
CCCCN(S(=O)(=O)c1ccc(cc1)N)CCCC
1709406
4AMINONNDI(NBUTYL)BENZENESULFAMIDE
4AMINONNDIBUTYLBENZENESULFONAMIDE
MFCD04035144
ZINC000002522955
ZINC02522955
ZINC2522955
CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)N
InChI=1SC14H24N2O2Sc1351116(12642)19(1718)149713(15)81014h710H36111215H212H3
BBL003628
Synonyms: ethyl[(5-ethyl-1,3,4-thiadiazol-2-yl)amino](oxo)acetate
Smiles: CCOC(=O)C(=O)Nc1nnc(s1)CC
CCOC(=O)C(=O)Nc1nnc(s1)CC
ETHYL((5ETHYL134THIADIAZOL2YL)AMINO)(OXO)ACETATE
ETHYL((5ETHYL134THIADIAZOL2YL)CARBAMOYL)FORMATE
ETHYL2((5ETHYL134THIADIAZOL2YL)AMINO)2OXOACETATE
83244977
ZINC02856779
ZINC2856779
CCC1=NN=C(S1)NC(=O)C(=O)OCC
InChI=1SC8H11N3O3Sc13510118(155)96(12)7(13)1442h34H212H3(H91112)
BBL003629
Synonyms: 4-amino-N-hexylbenzenesulfonamide
Smiles: CCCCCCNS(=O)(=O)c1ccc(cc1)N
CCCCCCNS(=O)(=O)c1ccc(cc1)N
((4AMINOPHENYL)SULFONYL)HEXYLAMINE
4AMINONHEXYLBENZENESULFONAMIDE
4AMINONHEXYLBENZENESULFONAMIDEHYDROCHLORIDE
67491887
BENZENESULFONAMIDE4AMINONHEXYL
MFCD06659955
ZINC000005138849
ZINC05138849
ZINC5138849
CCCCCCNS(=O)(=O)C1=CC=C(C=C1)N
InChI=1SC12H20N2O2Sc12345101417(1516)128611(13)7912h6914H251013H21H3
BBL003630
Synonyms: ethyl4-[(4-aminophenyl)sulfonyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)N
CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)N
1PIPERAZINECARBOXYLICACID4((4AMINOPHENYL)SULFONYL)ETHYLESTER
682341204
ETHYL4((4AMINOPHENYL)SULFONYL)PIPERAZINE1CARBOXYLATE
ETHYL4((4AMINOPHENYL)SULFONYL)PIPERAZINECARBOXYLATE
ETHYL4(4AMINOBENZENESULFONYL)PIPERAZINE1CARBOXYLATE
MFCD09271352
ZINC000013944174
ZINC13944174
ethyl4(4aminophenyl)sulfonylpiperazine1carboxylate
CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N
InChI=1SC13H19N3O4Sc122013(17)157916(10815)21(1819)125311(14)4612h36H271014H21H3
BBL003631
Synonyms: 4-amino-N-(3-ethoxypropyl)benzenesulfonamide
Smiles: CCOCCCNS(=O)(=O)c1ccc(cc1)N
CCOCCCNS(=O)(=O)c1ccc(cc1)N
MFCD09271350
ZINC000013944173
ZINC13944173
((4AMINOPHENYL)SULFONYL)(3ETHOXYPROPYL)AMINE
4AMINON(3ETHOXYPROPYL)BENZENESULFONAMIDE
931374673
CCOCCCNS(=O)(=O)C1=CC=C(C=C1)N
InChI=1SC11H18N2O3Sc12169381317(1415)116410(12)5711h4713H238912H21H3
BBL003632
Synonyms: N-[(2-chlorophenyl)carbonyl]-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccccc1Cl
OC(=O)CCNC(=O)c1ccccc1Cl
ZINC3160987
N((2CHLOROPHENYL)CARBONYL)BETAALANINE
N(2CHLOROBENZOYL)BETAALANINE
178497080
3((2CHLOROBENZOYL)AMINO)PROPANOICACID
3((2CHLOROPHENYL)CARBONYLAMINO)PROPANOICACID
3((2CHLOROPHENYL)FORMAMIDO)PROPANOICACID
3(2CHLOROBENZOYLAMINO)PROPIONICACID
C1=CC=C(C(=C1)C(=O)NCCC(=O)O)Cl
InChI=1SC10H10ClNO3c11842137(8)10(15)12659(13)14h14H56H2(H1215)(H1314)
BBL003633
Synonyms: N-[(3-bromophenyl)carbonyl]-beta-alanine
Smiles: OC(=O)CCNC(=O)c1cccc(c1)Br
OC(=O)CCNC(=O)c1cccc(c1)Br
ZINC000005427987
ZINC5427987
MFCD01009658
N((3BROMOPHENYL)CARBONYL)BETAALANINE
N(3BROMOBENZOYL)BETAALANINE
3((3BROMOPHENYL)CARBONYLAMINO)PROPANOICACID
3((3BROMOPHENYL)FORMAMIDO)PROPANOICACID
333394857
3((3bromobenzoyl)amino)propanoicacid
C1=CC(=CC(=C1)Br)C(=O)NCCC(=O)O
InChI=1SC10H10BrNO3c1183127(68)10(15)12549(13)14h136H45H2(H1215)(H1314)
BBL003634
Synonyms: 4-{[(4-nitrophenyl)sulfonyl]amino}butanoicacid
Smiles: OC(=O)CCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
OC(=O)CCCNS(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000002675146
ZINC2675146
MFCD00425182
4(((4NITROPHENYL)SULFONYL)AMINO)BUTANOICACID
4((4NITROPHENYL)SULFONYLAMINO)BUTANOICACID
4(4NITROBENZENESULFONAMIDO)BUTANOICACID
85844991
C1=CC(=CC=C1(N+)(=O)(O))S(=O)(=O)NCCCC(=O)O
InChI=1SC10H12N2O6Sc1310(14)2171119(1718)9538(469)12(15)16h3611H127H2(H1314)
BBL003635
Synonyms: 4-[(phenylcarbonyl)amino]butanoicacid
Smiles: O=C(c1ccccc1)NCCCC(=O)O
O=C(c1ccccc1)NCCCC(=O)O
ZINC2008743
35340637
4((PHENYLCARBONYL)AMINO)BUTANOICACID
4(BENZOYLAMINO)BUTANOICACID
4(BENZOYLAMINO)BUTYRICACID
4(PHENYLFORMAMIDO)BUTANOICACID
4BENZAMIDOBUTANOICACID
4BENZAMIDOBUTYRICACID
4BENZOYLAMINOBUTYRICACID
BUTANOICACID4(BENZOYLAMINO)
BUTANOICACID4(BENZOYLAMINO)(9CI)
BUTYRICACID4BENZAMIDO
GAMMABENZOYLAMINOBUTYRICACID
NBENZOYLGAMMAAMINOBUTYRICACID
BBL003636
Synonyms: 1-butanoylpiperidine-4-carboxylicacid
Smiles: CCCC(=O)N1CCC(CC1)C(=O)O
CCCC(=O)N1CCC(CC1)C(=O)O
MFCD09816262
ZINC000011566517
ZINC11566517
117704877
1BUTANOYLPIPERIDINE4CARBOXYLICACID
1BUTYRYL4PIPERIDINECARBOXYLICACID
1BUTYRYLPIPERIDINE4CARBOXYLICACID
InChI=1SC10H17NO3c1239(12)11648(5711)10(13)14h8H27H21H3(H1314)
BBL003637
Synonyms: 4-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}aniline
Smiles: COc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc(cc1)N
COc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc(cc1)N
MFCD07397893
ZINC000004943322
ZINC04943322
ZINC4943322
(4((4(2METHOXYPHENYL)PIPERAZIN1YL)SULFONYL)PHENYL)AMINE
1((PAMINOPHENYL)SULFONYL)4(OMETHOXYPHENYL)PIPERAZINE
4((4(2METHOXYPHENYL)PIPERAZIN1YL)SULFONYL)ANILINE
4(4(2METHOXYPHENYL)PIPERAZIN1YL)SULFONYLANILINE
4(4(2METHOXYPHENYL)PIPERAZIN1YLSULFONYL)ANILINE
4(4(2METHOXYPHENYL)PIPERAZINE1SULFONYL)PHENYLAMINE
71454132
COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N
InChI=1SC17H21N3O3Sc12317532416(17)19101220(131119)24(2122)158614(18)7915h29H101318H21H3
BBL003638
Synonyms: phenyl[(phenylcarbonyl)amino]aceticacid
Smiles: O=C(c1ccccc1)NC(c1ccccc1)C(=O)O
O=C(c1ccccc1)NC(c1ccccc1)C(=O)O
PHENYL((PHENYLCARBONYL)AMINO)ACETICACID
PHENYL(PHENYLFORMAMIDO)ACETICACID
(BENZOYLAMINO)(PHENYL)ACETICACID
(BENZOYLAMINO)PHENYLACETICACID
2(BENZOYLAMINO)2PHENYLACETICACID
2BENZAMIDO2PHENYLACETICACID
2PHENYL2(PHENYLCARBONYLAMINO)ACETICACID
2PHENYL2(PHENYLFORMAMIDO)ACETICACID
74536439
BENZENEACETICACIDALPHA(BENZOYLAMINO)
C1=CC=C(C=C1)C(C(=O)O)NC(=O)C2=CC=CC=C2
InChI=1SC15H13NO3c1714(1295261012)1613(15(18)19)117314811h11013H(H1617)(H1819)
BBL003639
Synonyms: 1,1-dimethylthiourea
Smiles: CN(C(=S)N)C
CN(C(=S)N)C
11DIMETHYL2THIOUREA
11DIMETHYLTHIOUREA
6972050
AMINO(DIMETHYLAMINO)METHANE1THIONE
NN1DIMETHYLTHIOUREA
NNDIMETHYLTHIOUREA
THIOUREANDIMETHYL
THIOUREANNDIMETHYL
THIOUREANNDIMETHYL(9CI)
UREA11DIMETHYL2THIO
UREA11DIMETHYL2THIO(8CI)
UREA1DIMETHYL2THIO
ZINC05688714
ZINC5688714
CN(C)C(=S)N
InChI=1SC3H8N2Sc15(2)3(4)6h12H3(H246)
BBL003640
Synonyms: N-(methylsulfonyl)alanine
Smiles: OC(=O)C(NS(=O)(=O)C)C
OC(=O)C(NS(=O)(=O)C)C
N(METHYLSULFONYL)ALANINE
2METHANESULFONAMIDOPROPANOICACID
879123601
2(methanesulfonamido)propanoicacid
CC(C(=O)O)NS(=O)(=O)C
InChI=1SC4H9NO4Sc13(4(6)7)510(28)9h35H12H3(H67)
BBL003641
Synonyms: ethyl(methylcarbamothioyl)carbamate
Smiles: CCOC(=O)NC(=S)NC
CCOC(=O)NC(=S)NC
ETHYL((METHYLAMINO)CARBONOTHIOYL)CARBAMATE
ETHYL(METHYLCARBAMOTHIOYL)CARBAMATE
ETHYLN(METHYLCARBAMOTHIOYL)CARBAMATE
51863435
ZINC40321608
InChI=1SC5H10N2O2Sc1395(8)74(10)62h3H212H3(H267810)
BBL003642
Synonyms: 1-(4-amino-2-methylphenyl)pyrrolidin-2-one
Smiles: Nc1ccc(c(c1)C)N1CCCC1=O
Nc1ccc(c(c1)C)N1CCCC1=O
ZINC01694486
ZINC1694486
1(2METHYL4AMINOPHENYL)PYRROLIDINE2ONE
1(4AMINO2METHYLPHENYL)2PYRROLIDINONE
1(4AMINO2METHYLPHENYL)PYRROLIDIN2ONE
13691297
2PYRROLIDINONE1(4AMINO2METHYLPHENYL)
CC1=C(C=CC(=C1)N)N2CCCC2=O
InChI=1SC11H14N2Oc1879(12)4510(8)1362311(13)14h457H23612H21H3
BBL003643
Synonyms: 3-[(4-chlorobenzyl)sulfanyl]-1H-1,2,4-triazol-5-amine
Smiles: Clc1ccc(cc1)CSc1n[nH]c(n1)N
Clc1ccc(cc1)CSc1n(nH)c(n1)N
1H124TRIAZOL3AMINE5(((4CHLOROPHENYL)METHYL)THIO)
3((4CHLOROPHENYL)METHYLSULFANYL)1H124TRIAZOL5AMINE
3((4CHLOROPHENYL)METHYLTHIO)1H124TRIAZOLE5YLAMINE
3AMINO5(PCHLOROBENZYLTHIO)STRIAZOLE
41266788
MFCD00215048
ZINC000001939759
ZINC01939759
ZINC1939759
3((4CHLOROBENZYL)SULFANYL)1H(124)TRIAZOL5YLAMINE
3((4CHLOROBENZYL)SULFANYL)1H124TRIAZOL5AMINE
3((4CHLOROBENZYL)SULFANYL)1H124TRIAZOL5YLAMINE
3((4CHLOROBENZYL)THIO)1H124TRIAZOL5AMINE
5(((4CHLOROPHENYL)METHYL)SULFANYL)2H124TRIAZOL3AMINE
5((4CHLOROBENZYL)SULFANYL)4H124TRIAZOL3YLAMINE
5((4CHLOROBENZYL)THIO)1H124TRIAZOL3AMINE
C1=CC(=CC=C1CSC2=NNC(=N2)N)Cl
InChI=1SC9H9ClN4Sc107316(247)5159128(11)13149h14H5H2(H311121314)
BBL003644
Synonyms: (2E)-3-(dimethylamino)-1-(4-nitrophenyl)prop-2-en-1-one
Smiles: CN(/C=C/C(=O)c1ccc(cc1)[N+](=O)[O-])C
CN(C=CC(=O)c1ccc(cc1)(N+)(=O)(O))C
DIMETHYLAMINONITROPHENYLPROPENONE
MFCD00121191
ZINC000001388174
ZINC01388174
ZINC1388174
(2E)3(DIMETHYLAMINO)1(4NITROPHENYL)PROP2EN1ONE
(E)3(DIMETHYLAMINO)1(4NITROPHENYL)PROP2EN1ONE
(E)4NITROBETA(DIMETHYLAMINO)ACRYLOPHENONE
1(4NITROPHENYL)3NNDIMETHYLAMINO2PROPEN1ONE
3(DIMETHYLAMINO)1(4NITROPHENYL)2PROPEN1ONE
3(DIMETHYLAMINO)1(4NITROPHENYL)PROP2EN1ONE
3DIMETHYLAMINO1(4NITROPHENYL)PROP2EN1ONE
68760112
BETA(DIMETHYLAMINO)4NITROACRYLOPHENONE
CN(C)C=CC(=O)C1=CC=C(C=C1)(N+)(=O)(O)
InChI=1SC11H12N2O3c112(2)8711(14)93510(649)13(15)16h38H12H3b87+
BBL003645
Synonyms: 1-(morpholin-4-yl)butane-1,3-dione
Smiles: O=C(N1CCOCC1)CC(=O)C
O=C(N1CCOCC1)CC(=O)C
ZINC000000061072
ZINC00061072
ZINC61072
MFCD00059774
MORPHOLINE4(13DIOXOBUTYL)
NACETOACETYLMORPHOLINE
1(MORPHOLIN4YL)BUTANE13DIONE
13BUTANEDIONE1(4MORPHOLINYL)
16695548
1MORPHOLIN4YLBUTANE13DIONE
1MORPHOLINO13BUTANEDIONE
1MORPHOLINOBUTANE13DIONE
4(13DIOXOBUTYL)MORPHOLINE
4(4MORPHOLINYL)4OXO2BUTANONE
4(MORPHOLIN4YL)4OXOBUTAN2ONE
4MORPHOLIN4YL4OXOBUTAN2ONE
ACETOACETOMORPHOLIDE
CC(=O)CC(=O)N1CCOCC1
InChI=1SC8H13NO3c17(10)68(11)92412539h26H21H3
BBL003646
Synonyms: 4-amino-N-(3-methoxypropyl)benzenesulfonamide
Smiles: COCCCNS(=O)(=O)c1ccc(cc1)N
COCCCNS(=O)(=O)c1ccc(cc1)N
MFCD09271351
ZINC000011851289
ZINC11851289
((4AMINOPHENYL)SULFONYL)(3METHOXYPROPYL)AMINE
27678199
4(N(3METHOXYPROPYL)SULPHAMOYL)ANILINE
4AMINON(3METHOXYPROPYL)BENZENESULFONAMIDE
BENZENESULFONAMIDE4AMINON(3METHOXYPROPYL)
COCCCNS(=O)(=O)C1=CC=C(C=C1)N
InChI=1SC10H16N2O3Sc1158271216(1314)10539(11)4610h3612H27811H21H3
BBL003647
Synonyms: N-(methylsulfonyl)-beta-alanine
Smiles: OC(=O)CCNS(=O)(=O)C
OC(=O)CCNS(=O)(=O)C
ZINC000004992771
ZINC4992771
METHYLSULFONYLBETAALANINE
MFCD06434734
N(METHYLSULFONYL)BETAALANINE
105611925
3((METHYLSULFONYL)AMINO)PROPANOICACID
3(METHANESULFONAMIDO)PROPANOICACID
3(METHYLSULFONAMIDO)PROPANOICACID
3METHANESULFONAMIDOPROPANOICACID
3METHANESULFONYLAMINOPROPIONICACID
CS(=O)(=O)NCCC(=O)O
InChI=1SC4H9NO4Sc110(89)5324(6)7h5H23H21H3(H67)
BBL003648
Synonyms: 1-[(1-tert-butyl-5-oxopyrrolidin-3-yl)carbonyl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)C1CC(=O)N(C1)C(C)(C)C
OC(=O)C1CCN(CC1)C(=O)C1CC(=O)N(C1)C(C)(C)C
ZINC000020200896
ZINC000020200898
1(1TERTBUTYL5OXOPYRROLIDINE3CARBONYL)PIPERIDINE4CARBOXYLICACID
1((1TERTBUTYL5OXOPYRROLIDIN3YL)CARBONYL)PIPERIDINE4CARBOXYLICACID
1199215865
MFCD13248750
CC(C)(C)N1CC(CC1=O)C(=O)N2CCC(CC2)C(=O)O
InChI=1SC15H24N2O4c115(23)17911(812(17)18)13(19)166410(5716)14(20)21h1011H49H213H3(H2021)
BBL003649
Synonyms: N-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]benzamide
Smiles: Nc1nnc(s1)CNC(=O)c1ccccc1
Nc1nnc(s1)CNC(=O)c1ccccc1
ZINC20205809
N((5AMINO134THIADIAZOL2YL)METHYL)BENZAMIDE
81837981
BENZAMIDEN((5AMINO134THIADIAZOL2YL)METHYL)
C1=CC=C(C=C1)C(=O)NCC2=NN=C(S2)N
InChI=1SC10H10N4OSc111014138(1610)6129(15)7421357h15H6H2(H21114)(H1215)
BBL003650
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-4-chlorobenzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NCCc1nnc(s1)N
Clc1ccc(cc1)S(=O)(=O)NCCc1nnc(s1)N
1199215649
N(2(5AMINO134THIADIAZOL2YL)ETHYL)4CHLOROBENZENESULFONAMIDE
ZINC20201289
C1=CC(=CC=C1S(=O)(=O)NCCC2=NN=C(S2)N)Cl
InChI=1SC10H11ClN4O2S2c117138(427)19(1617)13659141510(12)189h1413H56H2(H21215)
BBL003651
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-2-chlorobenzamide
Smiles: Nc1nnc(s1)CCNC(=O)c1ccccc1Cl
Nc1nnc(s1)CCNC(=O)c1ccccc1Cl
ZINC20201194
1199215729
N(2(5AMINO134THIADIAZOL2YL)ETHYL)2CHLOROBENZAMIDE
C1=CC=C(C(=C1)C(=O)NCCC2=NN=C(S2)N)Cl
InChI=1SC11H11ClN4OSc12842137(8)10(17)14659151611(13)189h14H56H2(H21316)(H1417)
BBL003652
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-3-methylbenzamide
Smiles: Cc1cccc(c1)C(=O)NCCc1nnc(s1)N
Cc1cccc(c1)C(=O)NCCc1nnc(s1)N
1199215854
MFCD13248736
N(2(5AMINO134THIADIAZOL2YL)ETHYL)3METHYLBENZAMIDE
ZINC000020201273
ZINC20201273
CC1=CC=CC(=C1)C(=O)NCCC2=NN=C(S2)N
InChI=1SC12H14N4OSc183249(78)11(17)146510151612(13)1810h247H56H21H3(H21316)(H1417)
BBL003653
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]benzamide
Smiles: Nc1nnc(s1)CCNC(=O)c1ccccc1
Nc1nnc(s1)CCNC(=O)c1ccccc1
ZINC000020205812
ZINC20205812
1199215569
MFCD13248733
N(2(5AMINO134THIADIAZOL2YL)ETHYL)BENZAMIDE
C1=CC=C(C=C1)C(=O)NCCC2=NN=C(S2)N
InChI=1SC11H12N4OSc121115149(1711)671310(16)8421358h15H67H2(H21215)(H1316)
BBL003654
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NCCc1nnc(s1)N
Cc1ccc(cc1)S(=O)(=O)NCCc1nnc(s1)N
1199215796
N(2(5AMINO134THIADIAZOL2YL)ETHYL)4METHYLBENZENESULFONAMIDE
ZINC20201295
CC1=CC=C(C=C1)S(=O)(=O)NCCC2=NN=C(S2)N
InChI=1SC11H14N4O2S2c18249(538)19(1617)137610141511(12)1810h2513H67H21H3(H21215)
BBL003655
Synonyms: 1-(3,3-dimethylbutanoyl)piperidine-4-carboxylicacid
Smiles: O=C(N1CCC(CC1)C(=O)O)CC(C)(C)C
O=C(N1CCC(CC1)C(=O)O)CC(C)(C)C
ZINC20205527
1(33DIMETHYLBUTANOYL)PIPERIDINE4CARBOXYLICACID
953743572
CC(C)(C)CC(=O)N1CCC(CC1)C(=O)O
InChI=1SC12H21NO3c112(23)810(14)13649(5713)11(15)16h9H48H213H3(H1516)
BBL003656
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)NCCc1nnc(s1)N
COc1ccc(cc1)S(=O)(=O)NCCc1nnc(s1)N
1199215774
N(2(5AMINO134THIADIAZOL2YL)ETHYL)4METHOXYBENZENESULFONAMIDE
ZINC20201312
COC1=CC=C(C=C1)S(=O)(=O)NCCC2=NN=C(S2)N
InChI=1SC11H14N4O3S2c1188249(538)20(1617)137610141511(12)1910h2513H67H21H3(H21215)
BBL003657
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NCCc1nnc(s1)N
COc1cccc(c1)C(=O)NCCc1nnc(s1)N
1199215821
N(2(5AMINO134THIADIAZOL2YL)ETHYL)3METHOXYBENZAMIDE
ZINC20201492
COC1=CC=CC(=C1)C(=O)NCCC2=NN=C(S2)N
InChI=1SC12H14N4O2Sc11894238(79)11(17)146510151612(13)1910h247H56H21H3(H21316)(H1417)
BBL003658
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-3,5-dimethoxybenzamide
Smiles: COc1cc(cc(c1)OC)C(=O)NCCc1nnc(s1)N
COc1cc(cc(c1)OC)C(=O)NCCc1nnc(s1)N
1199215661
N(2(5AMINO134THIADIAZOL2YL)ETHYL)35DIMETHOXYBENZAMIDE
ZINC20201457
COC1=CC(=CC(=C1)C(=O)NCCC2=NN=C(S2)N)OC
InChI=1SC13H16N4O3Sc119958(610(79)202)12(18)154311161713(14)2111h57H34H212H3(H21417)(H1518)
BBL003659
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-3-bromobenzamide
Smiles: Brc1cccc(c1)C(=O)NCCc1nnc(s1)N
Brc1cccc(c1)C(=O)NCCc1nnc(s1)N
N(2(5AMINO134THIADIAZOL2YL)ETHYL)3BROMOBENZAMIDE
ZINC20201407
1199215707
C1=CC(=CC(=C1)Br)C(=O)NCCC2=NN=C(S2)N
InChI=1SC11H11BrN4OSc1283127(68)10(17)14549151611(13)189h136H45H2(H21316)(H1417)
BBL003660
Synonyms: N-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-3-chlorobenzamide
Smiles: Clc1cccc(c1)C(=O)NCCc1nnc(s1)N
Clc1cccc(c1)C(=O)NCCc1nnc(s1)N
1199215763
MFCD13248734
N(2(5AMINO134THIADIAZOL2YL)ETHYL)3CHLOROBENZAMIDE
ZINC000020201360
ZINC20201360
C1=CC(=CC(=C1)Cl)C(=O)NCCC2=NN=C(S2)N
InChI=1SC11H11ClN4OSc1283127(68)10(17)14549151611(13)189h136H45H2(H21316)(H1417)
BBL003661
Synonyms: [4-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl](phenyl)methanone
Smiles: Nc1nnc(s1)C1CCN(CC1)C(=O)c1ccccc1
Nc1nnc(s1)C1CCN(CC1)C(=O)c1ccccc1
ZINC20203995
5(1BENZOYLPIPERIDIN4YL)134THIADIAZOL2AMINE
(4(5AMINO134THIADIAZOL2YL)PIPERIDIN1YL)(PHENYL)METHANONE
1199215650
(4(5amino134thiadiazol2yl)piperidin1yl)phenylmethanone
C1CN(CCC1C2=NN=C(S2)N)C(=O)C3=CC=CC=C3
InChI=1SC14H16N4OSc1514171612(2014)106818(9710)13(19)114213511h1510H69H2(H21517)
BBL003662
Synonyms: (2-aminophenyl)(4-phenylpiperazin-1-yl)methanone
Smiles: Nc1ccccc1C(=O)N1CCN(CC1)c1ccccc1
Nc1ccccc1C(=O)N1CCN(CC1)c1ccccc1
ZINC05616825
ZINC5616825
(2((4PHENYLPIPERAZIN1YL)CARBONYL)PHENYL)AMINE
(2AMINOPHENYL)(4PHENYLPIPERAZIN1YL)METHANONE
2((4PHENYLPIPERAZIN1YL)CARBONYL)ANILINE
2(4PHENYLPIPERAZINE1CARBONYL)ANILINE
401589024
C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3N
InChI=1SC17H19N3Oc1816954815(16)17(21)20121019(111320)146213714h19H101318H2
BBL003663
Synonyms: 1-[4-(diethylsulfamoyl)phenyl]-5-oxopyrrolidine-3-carboxylicacid
Smiles: CCN(S(=O)(=O)c1ccc(cc1)N1CC(CC1=O)C(=O)O)CC
CCN(S(=O)(=O)c1ccc(cc1)N1CC(CC1=O)C(=O)O)CC
1(4((DIETHYLAMINO)SULFONYL)PHENYL)5OXOPYRROLIDINE3CARBOXYLICACID
1(4(DIETHYLSULFAMOYL)PHENYL)5OXOPYRROLIDINE3CARBOXYLICACID
794554839
CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)O
InChI=1SC15H20N2O5Sc1316(42)23(2122)137512(6813)171011(15(19)20)914(17)18h5811H34910H212H3(H1920)
BBL003664
Synonyms: 2-amino-N-(3-ethoxypropyl)benzamide
Smiles: CCOCCCNC(=O)c1ccccc1N
CCOCCCNC(=O)c1ccccc1N
2AMINON(3ETHOXYPROPYL)BENZAMIDE
923184332
MFCD08444973
ZINC000020206764
ZINC20206764
CCOCCCNC(=O)C1=CC=CC=C1N
InChI=1SC12H18N2O2c12169581412(15)10634711(10)13h3467H258913H21H3(H1415)
BBL003665
Synonyms: N-(2-hydroxyethyl)-N-methylacetamide
Smiles: CN(C(=O)C)CCO
CN(C(=O)C)CCO
15567950
MFCD10048086
N(2HYDROXYETHYL)NMETHYLACETAMIDE
NMETHYLN(2HYDROXYETHYL)ACETAMIDE
NMETHYLNACETYLETHANOLAMINE
ZINC000011638226
ZINC11638226
CC(=O)N(C)CCO
InChI=1SC5H11NO2c15(8)6(2)347h7H34H212H3
BBL003666
Synonyms: 1-[4-(1H-imidazol-1-yl)phenyl]methanamine
Smiles: NCc1ccc(cc1)n1cncc1
NCc1ccc(cc1)n1cncc1
ZINC11757264
(4(1HIMIDAZOL1YL)PHENYL)METHANAMINE
(4(1HIMIDAZOL1YL)PHENYL)METHYLAMINE
(4(IMIDAZOL1YL)PHENYL)METHANAMINE
(4IMIDAZOL1YLPHENYL)METHANAMINE
(4IMIDAZOLYLPHENYL)METHYLAMINE
1(4(1HIMIDAZOL1YL)PHENYL)METHANAMINE
4(1HIMIDAZOL1YL)BENZENEMETHANAMINE
4(1HIMIDAZOL1YL)BENZYLAMINE
4(1IMIDAZOLYL)BENZYLAMINE
4(IMIDAZOL1YL)BENZYLAMINE
65113259
BENZENEMETHANAMINE4(1HIMIDAZOL1YL)
C1=CC(=CC=C1CN)N2C=CN=C2
InChI=1SC10H11N3c11791310(429)136512813h168H711H2
BBL003667
Synonyms: 4-methoxy-N-methylbenzamide
Smiles: CNC(=O)c1ccc(cc1)OC
CNC(=O)c1ccc(cc1)OC
NMETHYL4METHOXYBENZAMIDE
ZINC00336924
ZINC336924
(4METHOXYPHENYL)NMETHYLCARBOXAMIDE
3400224
4METHOXYNMETHYLBENZAMIDE
CNC(=O)C1=CC=C(C=C1)OC
InChI=1SC9H11NO2c1109(11)7358(122)647h36H12H3(H1011)
BBL003668
Synonyms: pyrimidin-2-ylcyanamide
Smiles: N#CNc1ncccn1
N#CNc1ncccn1
PYRIMIDIN2YLAMINOCARBONITRILE
PYRIMIDIN2YLCYANAMIDE
ZINC13638829
4425541
AMINOPYRIMIDIN2YLCARBONITRILE
CYANAMIDE2PYRIMIDINYL
CYANAMIDEN(2PYRIMIDINYL)
C1=CN=C(N=C1)NC#N
InChI=1SC5H4N4c6495721385h13H(H789)
BBL003669
Synonyms: 3-(pyrrolidin-1-yl)butan-1-amine
Smiles: NCCC(N1CCCC1)C
NCCC(N1CCCC1)C
893644503
(3PYRROLIDIN1YLBUTYL)AMINE
3(1PYRROLIDINYL)1BUTANAMINE
3(1PYRROLIDINYL)1BUTANAMINE95
3(PYRROLIDIN1YL)BUTAN1AMINE
3pyrrolidin1ylbutan1amine
CC(CCN)N1CCCC1
InChI=1SC8H18N2c18(459)10623710h8H279H21H3
BBL003670
Synonyms: 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
Smiles: NNC(=O)c1n[nH]c2c1CCCC2
NNC(=O)c1n(nH)c2c1CCCC2
4567tetrahydro1Hindazole3carbohydrazide
90434927
ZINC000003833224
ZINC03833224
ZINC3833224
MFCD00611197
C1CCC2=C(C1)C(=NN2)C(=O)NN
InChI=1SC8H12N4Oc9108(13)7531246(5)11127h149H2(H1013)(H1112)
BBL003671
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(2,4-dimethylphenyl)pyrrolidin-2-one
Smiles: Cc1ccc(c(c1)C)N1CC(CC1=O)c1nnc(s1)N
Cc1ccc(c(c1)C)N1CC(CC1=O)c1nnc(s1)N
1217862399
4(5AMINO134THIADIAZOL2YL)1(24DIMETHYLPHENYL)PYRROLIDIN2ONE
CC1=CC(=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)N)C
InChI=1SC14H16N4OSc183411(9(2)58)18710(612(18)19)13161714(15)2013h3510H67H212H3(H21517)
BBL003672
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(2-ethylphenyl)pyrrolidin-2-one
Smiles: CCc1ccccc1N1CC(CC1=O)c1nnc(s1)N
CCc1ccccc1N1CC(CC1=O)c1nnc(s1)N
1217862639
4(5AMINO134THIADIAZOL2YL)1(2ETHYLPHENYL)PYRROLIDIN2ONE
CCC1=CC=CC=C1N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC14H16N4OSc129534611(9)18810(712(18)19)13161714(15)2013h3610H278H21H3(H21517)
BBL003673
Synonyms: 1,2-benzoxazol-6-ol
Smiles: Oc1ccc2c(c1)onc2
Oc1ccc2c(c1)onc2
12benzoxazol6ol
65685554
BBL003674
Synonyms: 3-(4-fluorophenyl)propan-1-amine
Smiles: NCCCc1ccc(cc1)F
NCCCc1ccc(cc1)F
ZINC4992617
(3(4FLUOROPHENYL)PROPYL)AMINE
1(PARAFLUOROPHENYL)3AMINOPROPANE
101488657
3(4FLUOROPHENYL)1PROPANAMINE
3(4FLUOROPHENYL)1PROPYLAMINE
3(4FLUOROPHENYL)PROPAN1AMINE
3(4FLUOROPHENYL)PROPYLAMINE
4FLUOROBENZENEPROPANAMINE
BBL003675
Synonyms: 2-chloro-1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Smiles: ClCC(=O)N1c2ccc(cc2C(CC1(C)C)C)OC
ClCC(=O)N1c2ccc(cc2C(CC1(C)C)C)OC
ETHANONE2CHLORO1(34DIHYDRO6METHOXY224TRIMETHYL1(2H)QUINOLINYL)
MFCD02242243
ZINC000000308549
ZINC000000308550
2CHLORO1(6METHOXY224TRIMETHYL34DIHYDRO2HQUINOLIN1YL)ETHANONE
2CHLORO1(6METHOXY224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)ETHANONE
2CHLORO1(6METHOXY224TRIMETHYL34DIHYDROQUINOLIN1YL)ETHANONE
376371152
CC1CC(N(C2=C1C=C(C=C2)OC)C(=O)CCl)(C)C
InChI=1SC15H20ClNO2c110815(23)17(14(18)916)136511(194)712(10)13h5710H89H214H3
BBL003676
Synonyms: 2-chloro-1-(2,2,4,6-tetramethyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Smiles: ClCC(=O)N1c2ccc(cc2C(CC1(C)C)C)C
ClCC(=O)N1c2ccc(cc2C(CC1(C)C)C)C
2chloro1(2246tetramethyl34dihydroquinolin1(2H)yl)ethanone
364745608
2chloro1(2246tetramethyl34dihydroquinolin1yl)ethanone
CC1CC(N(C2=C1C=C(C=C2)C)C(=O)CCl)(C)C
InChI=1SC15H20ClNOc110561312(710)11(2)815(34)17(13)14(18)916h5711H89H214H3
BBL003677
Synonyms: (2Z)-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)ethanal
Smiles: O=C/C=C/1\N(C)c2c(C1(C)C)cccc2
O=CC=C1N(C)c2c(C1(C)C)cccc2
TRIBASENALDEHYDE
ZINC12412607
(13DIHYDRO133TRIMETHYL2HINDOL2YLIDENE)ACETALDEHYDE
(2Z)(133TRIMETHYL13DIHYDRO2HINDOL2YLIDENE)ACETALDEHYDE
(2Z)(133TRIMETHYL13DIHYDRO2HINDOL2YLIDENE)ETHANAL
(2Z)2(133TRIMETHYLINDOL2YLIDENE)ACETALDEHYDE
133TRIMETHYL2(FORMYLMETHYLENE)INDOLINE
133TRIMETHYL2INDOLINE
133TRIMETHYL2METHYLENEINDOLINEACETALDEHYDE
133TRIMETHYLDELTA(SUP2)ALPHAINDOLINEACETALDEHYDE
133TRIMETHYLDELTA2ALPHAINDOLINEACETALDEHYDE
13DIHYDRO133TRIMETHYL2HINDOL2YLIDENEACETALDEHYDE
2((2Z)133TRIMETHYLINDOL2YLIDENE)ACETALDEHYDE
2(FORMYLMETHYLENE)133TRIMETHYLINDOLINE
84833
ACETALDEHYDE(13DIHYDRO133TRIMETHYL2HINDOL2YLIDENE)
ACETALDEHYDE2(13DIHYDRO133TRIMETHYL2HINDOL2YLIDENE)
DELTA(SUP2ALPHA)INDOLINACETALDEHYDE133TRIMETHYL
DELTA(SUP2ALPHA)INDOLINACETALDEHYDE133TRIMETHYL(6CI)
DELTA(SUP2ALPHA)INDOLINEACETALDEHYDE133TRIMETHYL(7CI8CI)
DELTA2ALPHAINDOLINEACETALDEHYDE133TRIMETHYL
DELTA2ALPHAINDOLINEACETALDEHYDE133TRIMETHYL(8CI)
FISCHERSALDEHYDE
FISHERSALDEHYDE
(133TRIMETHYL13DIHYDROINDOL2YLIDENE)ACETALDEHYDE
(133TRIMETHYLINDOLIN2YLIDENE)ACETALDEHYDE
CC1(C2=CC=CC=C2N(C1=CC=O)C)C
InChI=1SC13H15NOc113(2)10645711(10)14(3)12(13)8915h49H13H3b128
BBL003678
Synonyms: ethyl1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)nc(n2CC)C
CCOC(=O)c1ccc2c(c1)nc(n2CC)C
ETHYL1ETHYL2METHYL13BENZODIAZOLE5CARBOXYLATE
ETHYL1ETHYL2METHYL1H13BENZODIAZOLE5CARBOXYLATE
ETHYL1ETHYL2METHYL1HBENZIMIDAZOLE5CARBOXYLATE
ETHYL1ETHYL2METHYLBENZIMIDAZOLE5CARBOXYLATE
1ETHYL2METHYL1HBENZOIMIDAZOLE5CARBOXYLICACIDETHYLESTER
1HBENZIMIDAZOLE5CARBOXYLICACID1ETHYL2METHYLETHYLESTER
92108026
MFCD00447373
ZINC000000061042
ZINC00061042
ZINC61042
CCN1C(=NC2=C1C=CC(=C2)C(=O)OCC)C
InChI=1SC13H16N2O2c14159(3)1411810(6712(11)15)13(16)1752h68H45H213H3
BBL003679
Synonyms: 3-(2,3-dihydro-1H-indol-1-yl)propan-1-amine
Smiles: NCCCN1CCc2c1cccc2
NCCCN1CCc2c1cccc2
ZINC6718984
3(23DIHYDRO1HINDOL1YL)PROPAN1AMINE
3(23DIHYDROINDOL1YL)PROPAN1AMINE
3(23DIHYDROINDOL1YL)PROPYLAMINE
3(INDOLIN1YL)PROPAN1AMINE
3INDOLINYLPROPYLAMINE
61123704
C1CN(C2=CC=CC=C21)CCCN
InChI=1SC11H16N2c12738139610412511(10)13h1245H36912H2
BBL003680
Synonyms: 1-(3,4-diethoxyphenyl)ethanamine
Smiles: CCOc1cc(ccc1OCC)C(N)C
CCOc1cc(ccc1OCC)C(N)C
1(34DIETHOXYPHENYL)ETHAN1AMINE
1(34DIETHOXYPHENYL)ETHANAMINE
1(34DIETHOXYPHENYL)ETHYLAMINE
105321504
CCOC1=C(C=C(C=C1)C(C)N)OCC
InChI=1SC12H19NO2c1414117610(9(3)13)812(11)1552h69H4513H213H3
BBL003681
Synonyms: 2-[(2-fluorobenzyl)sulfanyl]ethanamine
Smiles: NCCSCc1ccccc1F
NCCSCc1ccccc1F
ZINC4206152
(2((2FLUOROBENZYL)THIO)ETHYL)AMINE
2(((2FLUOROPHENYL)METHYL)SULFANYL)ETHAN1AMINE
2(((2FLUOROPHENYL)METHYL)SULFANYL)ETHANAMINE
2((2FLUOROBENZYL)SULFANYL)ETHANAMINE
2((2FLUOROBENZYL)THIO)ETHANAMINE
2((2FLUOROPHENYL)METHYLSULFANYL)ETHANAMINE
2((2FLUOROPHENYL)METHYLTHIO)ETHYLAMINE
2(2FLUOROBENZYLSULFANYL)ETHYLAMINE
753394013
C1=CC=C(C(=C1)CSCCN)F
InChI=1SC9H12FNSc10942138(9)7126511h14H5711H2
BBL003682
Synonyms: 2-amino-1,3-thiazole-4-carboxylicacid
Smiles: Nc1nc(cs1)C(=O)O
Nc1nc(cs1)C(=O)O
ZINC000004202305
ZINC4202305
MFCD00859429
112539089
2AMINO13THIAZOLE4CARBOXYLICACID
2AMINO4CARBOXY13THIAZOLE
2AMINO4CARBOXYTHIAZOLE
2AMINO4THIAZOLCARBOXYLICACIDHYDROBROMIDE
2AMINO4THIAZOLECARBOXYLICACID
2AMINOTHIAZOLE4CARBOXYLICACID
2AMINOTHIAZOLE4CARBOXYLICACIDHYDROBROMIDE
2AMINOTHIAZOLE4FORMICACID
4THIAZOLECARBOXYLICACID2AMINO
C1=C(N=C(S1)N)C(=O)O
InChI=1SC4H4N2O2Sc5462(194)3(7)8h1H(H256)(H78)
BBL003683
Synonyms: 4-(ethylsulfanyl)-1,3,5-triazin-2-amine
Smiles: CCSc1ncnc(n1)N
CCSc1ncnc(n1)N
4ETHYLTHIO135TRIAZINE2YLAMINE
1030520581
4(ETHYLSULFANYL)135TRIAZIN2AMINE
4(ETHYLTHIO)135TRIAZIN2AMINE
ZINC19093154
4ethylsulfanyl135triazin2amine
CCSC1=NC=NC(=N1)N
InChI=1SC5H8N4Sc121058374(6)95h3H2H21H3(H26789)
BBL003684
Synonyms: 4-methyl-2-[(4-methylphenyl)amino]pyrimidine-5-carboxylicacid
Smiles: Cc1ccc(cc1)Nc1ncc(c(n1)C)C(=O)O
Cc1ccc(cc1)Nc1ncc(c(n1)C)C(=O)O
ZINC8733480
4METHYL2((4METHYLPHENYL)AMINO)PYRIMIDINE5CARBOXYLICACID
4METHYL2PTOLYLAMINOPYRIMIDINE5CARBOXYLICACID
924834902
4methyl2(4methylanilino)pyrimidine5carboxylicacid
CC1=CC=C(C=C1)NC2=NC=C(C(=N2)C)C(=O)O
InChI=1SC13H13N3O2c183510(648)161314711(12(17)18)9(2)1513h37H12H3(H1718)(H141516)
BBL003685
Synonyms: 4-methyl-2-(piperidin-1-yl)pyrimidine-5-carboxylicacid
Smiles: OC(=O)c1cnc(nc1C)N1CCCCC1
OC(=O)c1cnc(nc1C)N1CCCCC1
ZINC11729722
4METHYL2(1PIPERIDINYL)5PYRIMIDINECARBOXYLICACID
4METHYL2(PIPERIDIN1YL)PYRIMIDINE5CARBOXYLICACID
4METHYL2PIPERIDIN1YLPYRIMIDINE5CARBOXYLICACID
4METHYL2PIPERIDYLPYRIMIDINE5CARBOXYLICACID
924872015
CC1=NC(=NC=C1C(=O)O)N2CCCCC2
InChI=1SC11H15N3O2c189(10(15)16)71211(138)145324614h7H26H21H3(H1516)
BBL003686
Synonyms: 1-(2-amino-2-oxoethyl)piperidine-3-carboxylicacid
Smiles: NC(=O)CN1CCCC(C1)C(=O)O
NC(=O)CN1CCCC(C1)C(=O)O
1(2AMINO2OXOETHYL)PIPERIDINE3CARBOXYLICACID
1(CARBAMOYLMETHYL)PIPERIDINE3CARBOXYLICACID
1CARBAMOYLMETHYLPIPERIDINE3CARBOXYLICACID
915922213
C1CC(CN(C1)CC(=O)N)C(=O)O
InChI=1SC8H14N2O3c97(11)5103126(410)8(12)13h6H15H2(H2911)(H1213)
BBL003687
Synonyms: 1-(4-methoxyphenoxy)propan-2-amine
Smiles: COc1ccc(cc1)OCC(N)C
COc1ccc(cc1)OCC(N)C
1(4METHOXYPHENOXY)PROP2YLAMINE
1(4METHOXYPHENOXY)PROPAN2AMINE
2(4METHOXYPHENOXY)1METHYLETHYLAMINE
(2(4METHOXYPHENOXY)1METHYLETHYL)AMINE
1(2AMINOPROPOXY)4METHOXYBENZENE
2(2AMINOPROPYL)4METHOXYPHENOL95
66145399
CC(COC1=CC=C(C=C1)OC)N
InChI=1SC10H15NO2c18(11)71310539(122)4610h368H711H212H3
BBL003688
Synonyms: 7-amino-2-methylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Smiles: Cc1nn2c(n1)ncc1c2ccn(c1=O)N
Cc1nn2c(n1)ncc1c2ccn(c1=O)N
PYRIDO(34E)(124)TRIAZOLO(15A)PYRIMIDIN6(7H)ONE7AMINO2METHYL
ZINC13634031
7AMINO2METHYL710DIHYDROPYRIDINO(34E)124TRIAZOLO(15A)PYRIMIDIN6ONE
7AMINO2METHYLPYRIDO(34E)(124)TRIAZOLO(15A)PYRIMIDIN6(7H)ONE
924834866
CC1=NN2C3=C(C=NC2=N1)C(=O)N(C=C3)N
InChI=1SC9H8N6Oc1512911467(15(9)135)2314(10)8(6)16h24H10H21H3
BBL003689
Synonyms: 3-(3-methoxyphenyl)-1H-pyrazole
Smiles: COc1cccc(c1)c1n[nH]cc1
COc1cccc(c1)c1n(nH)cc1
144026744
1HPYRAZOLE3(3METHOXYPHENYL)
1METHOXY3PYRAZOL3YLBENZENE
3(3METHOXYPHENYL)PYRAZOLE
3METHOXY1PYRAZOL3YLBENZENE
5(3METHOXYPHENYL)1HPYRAZOLE
ZINC12359634
ZINC2388330
3(3METHOXYPHENYL)1HPYRAZOLE
3(3METHOXYPHENYL)2HPYRAZOLE
COC1=CC=CC(=C1)C2=CC=NN2
InChI=1SC10H10N2Oc11394238(79)1056111210h27H1H3(H1112)
BBL003690
Synonyms: 1-[2-(5-methyl-1H-indol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)CCc1c[nH]c2c1cc(C)cc2
OC(=O)C1CC(=O)N(C1)CCc1c(nH)c2c1cc(C)cc2
1(2(5METHYL1HINDOL3YL)ETHYL)5OXOPYRROLIDINE3CARBOXYLICACID
931374786
CC1=CC2=C(C=C1)NC=C2CCN3CC(CC3=O)C(=O)O
InChI=1SC16H18N2O3c110231413(610)11(81714)4518912(16(20)21)715(18)19h23681217H4579H21H3(H2021)
BBL003691
Synonyms: 7-methyl-1,8-naphthyridin-2-amine
Smiles: Cc1ccc2c(n1)nc(cc2)N
Cc1ccc2c(n1)nc(cc2)N
ZINC32198129
1568930
18NAPHTHYRIDIN2AMINE7METHYL
18NAPHTHYRIDINE2AMINO7METHYL
2AMINO7METHYL18NAPHTHYRIDINE
2METHYL7AMINO18NAPHTHYRIDINE
7METHYL(18)NAPHTHYRIDIN2AMINE
7METHYL18NAPHTHYRIDIN2AMINE
CC1=NC2=C(C=C1)C=CC(=N2)N
InChI=1SC9H9N3c16237458(10)129(7)116h25H1H3(H2101112)
BBL003692
Synonyms: 4-(ethylamino)-3-nitrobenzoicacid
Smiles: CCNc1ccc(cc1[N+](=O)[O-])C(=O)O
CCNc1ccc(cc1(N+)(=O)(O))C(=O)O
2788741
4(ETHYLAMINO)3NITROBENZOICACID
4ETHYLAMINO3NITROBENZOICACID
4NETHYLAMINO3NITROBENZOICACID
BENZOICACID4(ETHYLAMINO)3NITRO
MFCD00546760
NETHYL3NITROPABA
NETHYL3NITROPABA(INCI)
NETHYL3NITROPARAAMINOBENZOICACID
ZINC000003885887
ZINC3885887
CCNC1=C(C=C(C=C1)C(=O)O)(N+)(=O)(O)
InChI=1SC9H10N2O4c12107436(9(12)13)58(7)11(14)15h3510H2H21H3(H1213)
BBL003693
Synonyms: 3-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Smiles: O=C1Nc2ccccc2C(=O)NC1C
O=C1Nc2ccccc2C(=O)NC1C
3METHYL34DIHYDRO1H14BENZODIAZEPINE25DIONE
3METHYL34DIHYDRO1HBENZO(E)(14)DIAZEPINE25DIONE
3METHYL34DIHYDRO2H14BENZODIAZEPINE25(1H)DIONE
1H14BENZODIAZEPINE25DIONE34DIHYDRO3METHYL
24919377
3METHYL1H3H4HBENZO(F)14DIAZAPERHYDROEPINE25DIONE
CC1C(=O)NC2=CC=CC=C2C(=O)N1
InChI=1SC10H10N2O2c169(13)12853247(8)10(14)116h26H1H3(H1114)(H1213)
BBL003694
Synonyms: methyl(5-oxo-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Smiles: COC(=O)CC1Cn2ncnc2NC1=O
COC(=O)CC1Cn2ncnc2NC1=O
methyl(5oxo4567tetrahydro(124)triazolo(15a)pyrimidin6yl)acetate
METHYL2(5OXO4H6H7H(124)TRIAZOLO(15A)PYRIMIDIN6YL)ACETATE
MFCD11058053
ZINC000014951183
ZINC000014951188
1030575224
METHYL(5HYDROXY67DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN6YL)ACETATE
methyl2(5oxo67dihydro1H(124)triazolo(15a)pyrimidin6yl)acetate
COC(=O)CC1CN2C(=NC1=O)N=CN2
InChI=1SC8H10N4O3c1156(13)253128(941012)117(5)14h45H23H21H3(H9101114)
BBL003695
Synonyms: (6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl)aceticacid
Smiles: OC(=O)Cn1ccc2c(c1=O)cnc1n2ncn1
OC(=O)Cn1ccc2c(c1=O)cnc1n2ncn1
ZINC000019702630
ZINC19702630
MFCD11058065
(6OXOPYRIDO(34E)(124)TRIAZOLO(15A)PYRIMIDIN7(6H)YL)ACETICACID
1030456826
2(6OXO710DIHYDROPYRIDINO(34E)124TRIAZOLO(15A)PYRIMIDIN7YL)ACETICACID
C1=CN(C(=O)C2=C1N3C(=NC=N3)N=C2)CC(=O)O
InChI=1SC10H7N5O3c168(17)4142176(9(14)18)311101251315(7)10h135H4H2(H1617)
BBL003696
Synonyms: 4-(3-chlorophenyl)-3-ethyl-1H-pyrazol-5-amine
Smiles: CCc1n[nH]c(c1c1cccc(c1)Cl)N
CCc1n(nH)c(c1c1cccc(c1)Cl)N
4(3CHLOROPHENYL)3ETHYL1HPYRAZOL5AMINE
4(3CHLOROPHENYL)3ETHYLPYRAZOLE5YLAMINE
955584891
MFCD09439010
ZINC000008701447
ZINC08701447
ZINC8701447
4(3chlorophenyl)5ethyl1Hpyrazol3amine
CCC1=C(C(=NN1)N)C2=CC(=CC=C2)Cl
InChI=1SC11H12ClN3c12910(11(13)15149)74358(12)67h36H2H21H3(H3131415)
BBL003697
Synonyms: N-tert-butyl-2-chloroacetamide
Smiles: ClCC(=O)NC(C)(C)C
ClCC(=O)NC(C)(C)C
15678996
ACETAMIDE2CHLORON(11DIMETHYLETHYL)
ACETAMIDE2CHLORONTBUTYL
N(TERTBUTYL)2CHLOROACETAMIDE
N1(TERTBUTYL)2CHLOROACETAMIDE
NTERTBUTYL2CHLOROACETAMIDE
NTERTBUTYLCHLOROACETAMIDE
ZINC01586620
ZINC1586620
CC(C)(C)NC(=O)CCl
InChI=1SC6H12ClNOc16(23)85(9)47h4H213H3(H89)
BBL003698
Synonyms: 4-amino-N-butylbenzenesulfonamide
Smiles: CCCCNS(=O)(=O)c1ccc(cc1)N
CCCCNS(=O)(=O)c1ccc(cc1)N
ZINC01761870
ZINC1761870
((4AMINOPHENYL)SULFONYL)BUTYLAMINE
1829829
4AMINON(NBUTYL)BENZENESULFAMIDE
4AMINONBUTYLBENZENE1SULFONAMIDE
4AMINONBUTYLBENZENESULFONAMIDE
CCCCNS(=O)(=O)C1=CC=C(C=C1)N
InChI=1SC10H16N2O2Sc12381215(1314)10649(11)5710h4712H23811H21H3
BBL003699
Synonyms: 2-(methylamino)-1,3-thiazole-4-carboxylicacid
Smiles: CNc1scc(n1)C(=O)O
CNc1scc(n1)C(=O)O
ZINC40231585
1199216028
2(METHYLAMINO)13THIAZOLE4CARBOXYLICACID
2(METHYLAMINO)THIAZOLE4CARBOXYLICACID
CNC1=NC(=CS1)C(=O)O
InChI=1SC5H6N2O2Sc16573(2105)4(8)9h2H1H3(H67)(H89)
BBL003700
Synonyms: 4-[(2-ethylpiperidin-1-yl)sulfonyl]aniline
Smiles: CCC1CCCCN1S(=O)(=O)c1ccc(cc1)N
CCC1CCCCN1S(=O)(=O)c1ccc(cc1)N
(4((2ETHYLPIPERIDIN1YL)SULFONYL)PHENYL)AMINE
4((2ETHYLPIPERIDIN1YL)SULFONYL)ANILINE
4((2ETHYLPIPERIDYL)SULFONYL)PHENYLAMINE
4(2ETHYLPIPERIDIN1YL)SULFONYLANILINE
4(2ETHYLPIPERIDIN1YLSULFONYL)ANILINE
4(2ETHYLPIPERIDINE1SULFONYL)PHENYLAMINE
436091871
CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)N
InChI=1SC13H20N2O2Sc12125341015(12)18(1617)138611(14)7913h6912H251014H21H3
BBL003701
Synonyms: 4-(3,4-dihydroquinolin-1(2H)-ylsulfonyl)aniline
Smiles: Nc1ccc(cc1)S(=O)(=O)N1CCCc2c1cccc2
Nc1ccc(cc1)S(=O)(=O)N1CCCc2c1cccc2
ZINC00572310
ZINC572310
4(34DIHYDRO2HQUINOLIN1YLSULFONYL)ANILINE
4(34DIHYDRO2HQUINOLINE1SULFONYL)ANILINE
(4(34DIHYDRO2HQUINOLIN1YLSULFONYL)PHENYL)AMINE
4((34DIHYDROQUINOLIN1(2H)YL)SULFONYL)ANILINE
4(34DIHYDROQUINOLIN1(2H)YLSULFONYL)ANILINE
5455890
BENZENAMINE4((34DIHYDRO1(2H)QUINOLINYL)SULFONYL)
C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)N
InChI=1SC15H16N2O2Sc16137914(10813)20(1819)17113512412615(12)17h124610H351116H2
BBL003702
Synonyms: 5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)CSc1ccccc1
Nc1nnc(s1)CSc1ccccc1
ZINC03716265
ZINC3716265
(134)THIADIAZOLE2AMINO5PHENYLSULFANYLMETHYL
134THIADIAZOL2AMINE5((PHENYLTHIO)METHYL)
5((PHENYLSULFANYL)METHYL)134THIADIAZOL2AMINE
5((PHENYLTHIO)METHYL)134THIADIAZOL2AMINE
5(PHENYLSULFANYLMETHYL)134THIADIAZOL2AMINE
88743037
C1=CC=C(C=C1)SCC2=NN=C(S2)N
InChI=1SC9H9N3S2c10912118(149)6137421357h15H6H2(H21012)
BBL003703
Synonyms: 4-[(2-methylbutanoyl)amino]benzoicacid
Smiles: CCC(C(=O)Nc1ccc(cc1)C(=O)O)C
CCC(C(=O)Nc1ccc(cc1)C(=O)O)C
4((2METHYLBUTANOYL)AMINO)BENZOICACID
925068684
4(2METHYLBUTANAMIDO)BENZOICACID
4(2METHYLBUTANOYLAMINO)BENZOICACID
CCC(C)C(=O)NC1=CC=C(C=C1)C(=O)O
InChI=1SC12H15NO3c138(2)11(14)1310649(5710)12(15)16h48H3H212H3(H1314)(H1516)
BBL003704
Synonyms: N-(butan-2-yl)-2-chloroacetamide
Smiles: CCC(NC(=O)CCl)C
CCC(NC(=O)CCl)C
2CHLORON(METHYLPROPYL)ACETAMIDE
2CHLORON(SECBUTYL)ACETAMIDE
32322739
ACETAMIDE2CHLORON(1METHYLPROPYL)
MFCD00791326
N(BUTAN2YL)2CHLOROACETAMIDE
N(SECBUTYL)2CHLOROACETAMIDE
NBUTAN2YL2CHLOROACETAMIDE
ZINC000003103947
ZINC000003103948
CCC(C)NC(=O)CCl
InChI=1SC6H12ClNOc135(2)86(9)47h5H34H212H3(H89)
BBL003705
Synonyms: oxo(propylamino)aceticacid
Smiles: CCCNC(=O)C(=O)O
CCCNC(=O)C(=O)O
NPROPYLOXAMIDICACID
OXO(PROPYLAMINO)ACETICACID
ZINC19092275
(PROPYLCARBAMOYL)FORMICACID
2OXO2(PROPYLAMINO)ACETICACID
81682533
ACETICACID2OXO2(PROPYLAMINO)
InChI=1SC5H9NO3c12364(7)5(8)9h23H21H3(H67)(H89)
BBL003706
Synonyms: 1-(ethoxyacetyl)piperidine-4-carboxylicacid
Smiles: CCOCC(=O)N1CCC(CC1)C(=O)O
CCOCC(=O)N1CCC(CC1)C(=O)O
1(2ETHOXYACETYL)4PIPERIDINECARBOXYLICACID
1(2ETHOXYACETYL)PIPERIDINE4CARBOXYLICACID
1042796133
ZINC19092815
1(ETHOXYACETYL)4PIPERIDINECARBOXYLICACID
1(ETHOXYACETYL)PIPERIDINE4CARBOXYLICACID
InChI=1SC10H17NO4c121579(12)11538(4611)10(13)14h8H27H21H3(H1314)
BBL003707
Synonyms: 1-(dimethylcarbamoyl)piperidine-4-carboxylicacid
Smiles: CN(C(=O)N1CCC(CC1)C(=O)O)C
CN(C(=O)N1CCC(CC1)C(=O)O)C
ZINC259755
1((DIMETHYLAMINO)CARBONYL)4PIPERIDINECARBOXYLICACID
1((DIMETHYLAMINO)CARBONYL)PIPERIDINE4CARBOXYLICACID
1(DIMETHYLCARBAMOYL)PIPERIDINE4CARBOXYLICACID
1(NNDIMETHYLCARBAMOYL)PIPERIDINE4CARBOXYLICACID
333985798
4PIPERIDINECARBOXYLICACID1((DIMETHYLAMINO)CARBONYL)
CN(C)C(=O)N1CCC(CC1)C(=O)O
InChI=1SC9H16N2O3c110(2)9(14)11537(4611)8(12)13h7H36H212H3(H1213)
BBL003708
Synonyms: 2-chloro-1-(piperidin-1-yl)propan-1-one
Smiles: CC(C(=O)N1CCCCC1)Cl
CC(C(=O)N1CCCCC1)Cl
1(2CHLOROPROPANOYL)PIPERIDINE
1PROPANONE2CHLORO1(1PIPERIDINYL)
2CHLORO1(PIPERIDIN1YL)PROPAN1ONE
2CHLORO1PIPERIDIN1YLPROPAN1ONE
66203961
InChI=1SC8H14ClNOc17(9)8(11)105324610h7H26H21H3
BBL003709
Synonyms: 2-chloro-N-propylpropanamide
Smiles: CCCNC(=O)C(Cl)C
CCCNC(=O)C(Cl)C
2CHLORONPROPYLPROPANAMIDE
94318715
MFCD09802012
PROPANAMIDE2CHLORONPROPYL
ZINC000012504913
ZINC000012504914
CCCNC(=O)C(C)Cl
InChI=1SC6H12ClNOc13486(9)5(2)7h5H34H212H3(H89)
BBL003710
Synonyms: 4-(chloromethyl)-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: ClCc1nc(N)nc(n1)N1CCOCC1
ClCc1nc(N)nc(n1)N1CCOCC1
STRIAZINE2AMINO4(CHLOROMETHYL)6MORPHOLINO
ZINC00080658
ZINC80658
135TRIAZIN2AMINE4(CHLOROMETHYL)6(4MORPHOLINYL)
21868417
2AMINO4(CHLOROMETHYL)6MORPHOLINOSTRIAZINE
2AMINO4CHLOROMETHYL6MORPHOLINO135TRIAZINE
2AMINO4MORPHOLINO6CHLOROMETHYL135TRIAZINE
4(CHLOROMETHYL)6(4MORPHOLINYL)135TRIAZIN2AMINE
4(CHLOROMETHYL)6(MORPHOLIN4YL)135TRIAZIN2AMINE
4(CHLOROMETHYL)6MORPHOLIN4YL135TRIAZIN2AMINE
4(CHLOROMETHYL)6MORPHOLIN4YL135TRIAZINE2YLAMINE
6(CHLOROMETHYL)4MORPHOLIN4YL135TRIAZINE2YLAMINE
C1COCCN1C2=NC(=NC(=N2)CCl)N
InChI=1SC8H12ClN5Oc956117(10)138(126)1413154214h15H2(H210111213)
BBL003711
Synonyms: 2-(ethylsulfonyl)benzoicacid
Smiles: CCS(=O)(=O)c1ccccc1C(=O)O
CCS(=O)(=O)c1ccccc1C(=O)O
MFCD06655817
ZINC000004206494
ZINC4206494
161058271
2(ETHANESULFONYL)BENZOICACID
2(ETHYLSULFONYL)BENZOICACID
2ETHANESULFONYLBENZOICACID
2ETHYLSULFONYLBENZOICACID
CCS(=O)(=O)C1=CC=CC=C1C(=O)O
InChI=1SC9H10O4Sc1214(1213)864357(8)9(10)11h36H2H21H3(H1011)
BBL003712
Synonyms: 1-cyclopentyl-5-oxopyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)C1CCCC1
OC(=O)C1CC(=O)N(C1)C1CCCC1
ZINC000000266732
ZINC000000266734
MFCD03834528
1CYCLOPENTYL5OXO3PYRROLIDINECARBOXYLICACID
1CYCLOPENTYL5OXOPYRROLIDINE3CARBOXYLICACID
3PYRROLIDINECARBOXYLICACID1CYCLOPENTYL5OXO
696647786
C1CCC(C1)N2CC(CC2=O)C(=O)O
InChI=1SC10H15NO3c12957(10(13)14)611(9)831248h78H16H2(H1314)
BBL003713
Synonyms: [(4-fluorobenzyl)sulfonyl]aceticacid
Smiles: OC(=O)CS(=O)(=O)Cc1ccc(cc1)F
OC(=O)CS(=O)(=O)Cc1ccc(cc1)F
ZINC12359436
2(4FLUOROBENZYLSULFONYL)ACETICACID
222639410
4FLUOROBENZYLSULFONYLACETICACID
ACETICACID2(((4FLUOROPHENYL)METHYL)SULFONYL)
((4FLUOROBENZYL)SULFONYL)ACETICACID
(4FLUOROALPHATOLULENESULFONYL)ACETICACID
(4FLUOROATOLULENESULFONYL)ACETICACID
(4FLUOROPHENYL)METHANESULFONYLACETICACID
(4FLUOROPHENYLMETHANESULFONYL)ACETICACID
2(((4FLUOROPHENYL)METHYL)SULFONYL)ACETICACID
2((4FLUOROBENZYL)SULFONYL)ACETICACID
2((4FLUOROPHENYL)METHANESULFONYL)ACETICACID
2((4fluorophenyl)methylsulfonyl)aceticacid
C1=CC(=CC=C1CS(=O)(=O)CC(=O)O)F
InChI=1SC9H9FO4Sc108317(248)515(1314)69(11)12h14H56H2(H1112)
BBL003714
Synonyms: morpholin-4-yl(oxo)aceticacid
Smiles: O=C(C(=O)O)N1CCOCC1
O=C(C(=O)O)N1CCOCC1
ZINC19092483
28911344
2MORPHOLINO2OXOACETICACID
4MORPHOLINEACETICACIDAOXO
4MORPHOLINYL(OXO)ACETICACID
MORPHOLIN4YL(OXO)ACETICACID
2morpholin4yl2oxoaceticacid
C1COCCN1C(=O)C(=O)O
InChI=1SC6H9NO4c85(6(9)10)71311427h14H2(H910)
BBL003715
Synonyms: 1-[(3-fluorophenyl)carbonyl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)c1cccc(c1)F
OC(=O)C1CCN(CC1)C(=O)c1cccc(c1)F
ZINC000000873482
ZINC873482
MFCD04035220
1((3FLUOROPHENYL)CARBONYL)PIPERIDINE4CARBOXYLICACID
1(3FLUOROBENZOYL)PIPERIDINE4CARBOXYLICACID
436093139
C1CN(CCC1C(=O)O)C(=O)C2=CC(=CC=C2)F
InChI=1SC13H14FNO3c141131210(811)12(16)15649(5715)13(17)18h1389H47H2(H1718)
BBL003716
Synonyms: 1-(methoxyacetyl)piperidine-3-carboxylicacid
Smiles: COCC(=O)N1CCCC(C1)C(=O)O
COCC(=O)N1CCCC(C1)C(=O)O
1(2METHOXYACETYL)PIPERIDINE3CARBOXYLICACID
1(METHOXYACETYL)3PIPERIDINECARBOXYLICACID
1(METHOXYACETYL)PIPERIDINE3CARBOXYLICACID
926238940
InChI=1SC9H15NO4c11468(11)104237(510)9(12)13h7H26H21H3(H1213)
BBL003717
Synonyms: 1-(dimethylcarbamoyl)piperidine-3-carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)N(C)C
OC(=O)C1CCCN(C1)C(=O)N(C)C
ZINC000000259760
ZINC000000259762
MFCD03830326
1((DIMETHYLAMINO)CARBONYL)3PIPERIDINECARBOXYLICACID
1((DIMETHYLAMINO)CARBONYL)PIPERIDINE3CARBOXYLICACID
1(DIMETHYLCARBAMOYL)PIPERIDINE3CARBOXYLICACID
702670211
CN(C)C(=O)N1CCCC(C1)C(=O)O
InChI=1SC9H16N2O3c110(2)9(14)115347(611)8(12)13h7H36H212H3(H1213)
BBL003718
Synonyms: 2-chloro-1-(pyrrolidin-1-yl)propan-1-one
Smiles: CC(C(=O)N1CCCC1)Cl
CC(C(=O)N1CCCC1)Cl
1(2CHLOROPROPANOYL)PYRROLIDINE
1PROPANONE2CHLORO1(1PYRROLIDINYL)
2CHLORO1(PYRROLIDIN1YL)PROPAN1ONE
2CHLORO1PYRROLIDIN1YLPROPAN1ONE
75115525
InChI=1SC7H12ClNOc16(8)7(10)942359h6H25H21H3
BBL003719
Synonyms: 2-chloro-N-methylpropanamide
Smiles: CNC(=O)C(Cl)C
CNC(=O)C(Cl)C
2CHLORONMETHYLPROPANAMIDE
42275478
PROPANAMIDE2CHLORONMETHYL
CC(C(=O)NC)Cl
InChI=1SC4H8ClNOc13(5)4(7)62h3H12H3(H67)
BBL003720
Synonyms: 2-chloro-N-ethylpropanamide
Smiles: CCNC(=O)C(Cl)C
CCNC(=O)C(Cl)C
2CHLORONETHYLPROPANAMIDE
2CHLORONETHYLPROPIONAMIDE
67791815
CCNC(=O)C(C)Cl
InChI=1SC5H10ClNOc1375(8)4(2)6h4H3H212H3(H78)
BBL003721
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(4-methylphenyl)pyrrolidin-2-one
Smiles: Cc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
Cc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
4(5AMINO(134)THIADIAZOL2YL)1PTOLYLPYRROLIDIN2ONE
4(5AMINO134THIADIAZOL2YL)1(4METHYLPHENYL)PYRROLIDIN2ONE
887041738
CC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC13H14N4OSc182410(538)1779(611(17)18)12151613(14)1912h259H67H21H3(H21416)
BBL003722
Synonyms: 5-oxo-1-(pentan-3-yl)pyrrolidine-3-carboxylicacid
Smiles: CCC(N1CC(CC1=O)C(=O)O)CC
CCC(N1CC(CC1=O)C(=O)O)CC
1(1ETHYLPROPYL)5OXOPYRROLIDINE3CARBOXYLICACID
944511540
5OXO1(PENTAN3YL)PYRROLIDINE3CARBOXYLICACID
5OXO1PENTAN3YLPYRROLIDINE3CARBOXYLICACID
CCC(CC)N1CC(CC1=O)C(=O)O
InChI=1SC10H17NO3c138(42)1167(10(13)14)59(11)12h78H36H212H3(H1314)
BBL003723
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(4-methoxyphenyl)pyrrolidin-2-one
Smiles: COc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
COc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
4(5AMINO(134)THIADIAZOL2YL)1(4METHOXYPHENYL)PYRROLIDIN2ONE
4(5AMINO134THIADIAZOL2YL)1(4METHOXYPHENYL)PYRROLIDIN2ONE
887041783
COC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC13H14N4O2Sc11910429(3510)1778(611(17)18)12151613(14)2012h258H67H21H3(H21416)
BBL003724
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(3-chloro-2-methylphenyl)pyrrolidin-2-one
Smiles: O=C1CC(CN1c1cccc(c1C)Cl)c1nnc(s1)N
O=C1CC(CN1c1cccc(c1C)Cl)c1nnc(s1)N
1142202467
4(5AMINO134THIADIAZOL2YL)1(3CHLORO2METHYLPHENYL)PYRROLIDIN2ONE
CC1=C(C=CC=C1Cl)N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC13H13ClN4OSc179(14)32410(7)1868(511(18)19)12161713(15)2012h248H56H21H3(H21517)
BBL003725
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(4-fluorophenyl)pyrrolidin-2-one
Smiles: Fc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
Fc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
1142202456
4(5AMINO134THIADIAZOL2YL)1(4FLUOROPHENYL)PYRROLIDIN2ONE
C1C(CN(C1=O)C2=CC=C(C=C2)F)C3=NN=C(S3)N
InChI=1SC12H11FN4OSc138139(428)1767(510(17)18)11151612(14)1911h147H56H2(H21416)
BBL003726
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(3-chloro-4-methylphenyl)pyrrolidin-2-one
Smiles: O=C1CC(CN1c1ccc(c(c1)Cl)C)c1nnc(s1)N
O=C1CC(CN1c1ccc(c(c1)Cl)C)c1nnc(s1)N
ZINC000020204047
ZINC000020204049
MFCD12028224
1142202423
4(5AMINO134THIADIAZOL2YL)1(3CHLORO4METHYLPHENYL)PYRROLIDIN2ONE
CC1=C(C=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)N)Cl
InChI=1SC13H13ClN4OSc17239(510(7)14)1868(411(18)19)12161713(15)2012h2358H46H21H3(H21517)
BBL003727
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(4-chlorophenyl)pyrrolidin-2-one
Smiles: Clc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
Clc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
1142202398
4(5AMINO134THIADIAZOL2YL)1(4CHLOROPHENYL)PYRROLIDIN2ONE
C1C(CN(C1=O)C2=CC=C(C=C2)Cl)C3=NN=C(S3)N
InChI=1SC12H11ClN4OSc138139(428)1767(510(17)18)11151612(14)1911h147H56H2(H21416)
BBL003728
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(4-ethylphenyl)pyrrolidin-2-one
Smiles: CCc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
CCc1ccc(cc1)N1CC(CC1=O)c1nnc(s1)N
1142202387
4(5AMINO134THIADIAZOL2YL)1(4ETHYLPHENYL)PYRROLIDIN2ONE
CCC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC14H16N4OSc1293511(649)18810(712(18)19)13161714(15)2013h3610H278H21H3(H21517)
BBL003729
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(2-methylphenyl)pyrrolidin-2-one
Smiles: O=C1CC(CN1c1ccccc1C)c1nnc(s1)N
O=C1CC(CN1c1ccccc1C)c1nnc(s1)N
1142202376
4(5AMINO134THIADIAZOL2YL)1(2METHYLPHENYL)PYRROLIDIN2ONE
CC1=CC=CC=C1N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC13H14N4OSc18423510(8)1779(611(17)18)12151613(14)1912h259H67H21H3(H21416)
BBL003730
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(3,4-dimethylphenyl)pyrrolidin-2-one
Smiles: O=C1CC(CN1c1ccc(c(c1)C)C)c1nnc(s1)N
O=C1CC(CN1c1ccc(c(c1)C)C)c1nnc(s1)N
1142202343
4(5AMINO134THIADIAZOL2YL)1(34DIMETHYLPHENYL)PYRROLIDIN2ONE
CC1=C(C=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)N)C
InChI=1SC14H16N4OSc183411(59(8)2)18710(612(18)19)13161714(15)2013h3510H67H212H3(H21517)
BBL003731
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-phenylpyrrolidin-2-one
Smiles: O=C1CC(CN1c1ccccc1)c1nnc(s1)N
O=C1CC(CN1c1ccccc1)c1nnc(s1)N
1142202310
4(5AMINO134THIADIAZOL2YL)1PHENYLPYRROLIDIN2ONE
C1C(CN(C1=O)C2=CC=CC=C2)C3=NN=C(S3)N
InChI=1SC12H12N4OSc1312151411(1812)8610(17)16(78)9421359h158H67H2(H21315)
BBL003732
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(3,5-dimethylphenyl)pyrrolidin-2-one
Smiles: Cc1cc(C)cc(c1)N1CC(CC1=O)c1nnc(s1)N
Cc1cc(C)cc(c1)N1CC(CC1=O)c1nnc(s1)N
1142202309
4(5AMINO134THIADIAZOL2YL)1(35DIMETHYLPHENYL)PYRROLIDIN2ONE
CC1=CC(=CC(=C1)N2CC(CC2=O)C3=NN=C(S3)N)C
InChI=1SC14H16N4OSc1839(2)511(48)18710(612(18)19)13161714(15)2013h3510H67H212H3(H21517)
BBL003733
Synonyms: 4-(5-amino-1,3,4-thiadiazol-2-yl)-1-(3-methylphenyl)pyrrolidin-2-one
Smiles: Cc1cccc(c1)N1CC(CC1=O)c1nnc(s1)N
Cc1cccc(c1)N1CC(CC1=O)c1nnc(s1)N
1142202296
4(5AMINO134THIADIAZOL2YL)1(3METHYLPHENYL)PYRROLIDIN2ONE
CC1=CC(=CC=C1)N2CC(CC2=O)C3=NN=C(S3)N
InChI=1SC13H14N4OSc1832410(58)1779(611(17)18)12151613(14)1912h259H67H21H3(H21416)
BBL003734
Synonyms: 2-(2-methyl-1H-benzimidazol-1-yl)acetohydrazide
Smiles: NNC(=O)Cn1c(C)nc2c1cccc2
NNC(=O)Cn1c(C)nc2c1cccc2
ZINC000000235963
ZINC00235963
ZINC235963
2(2METHYL13BENZODIAZOL1YL)ACETOHYDRAZIDE
2(2METHYL1HBENZIMIDAZOL1YL)ACETOHYDRAZIDE
(2METHYL1HBENZOIMIDAZOLE1YL)ACETOHYDRAZIDE
(2METHYLBENZOIMIDAZOL1YL)ACETICACIDHYDRAZIDE
2(2METHYLBENZIMIDAZOL1YL)ACETOHYDRAZIDE
2(2METHYLBENZIMIDAZOLYL)ACETOHYDRAZIDE
97420401
MFCD00227235
CC1=NC2=CC=CC=C2N1CC(=O)NN
InChI=1SC10H12N4Oc1712842359(8)14(7)610(15)1311h25H611H21H3(H1315)
BBL003735
Synonyms: 4-amino-N,N-dipropylbenzenesulfonamide
Smiles: CCCN(S(=O)(=O)c1ccc(cc1)N)CCC
CCCN(S(=O)(=O)c1ccc(cc1)N)CCC
((4AMINOPHENYL)SULFONYL)DIPROPYLAMINE
21646924
4AMINONNDI(NPROPYL)BENZENESULFAMIDE
4AMINONNDIPROPYLBENZENESULFONAMIDE
MFCD05666700
ZINC000002821740
ZINC02821740
ZINC2821740
CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)N
InChI=1SC12H20N2O2Sc13914(1042)17(1516)127511(13)6812h58H3491013H212H3
BBL003736
Synonyms: 4-amino-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)NCC1CCCO1
Nc1ccc(cc1)S(=O)(=O)NCC1CCCO1
ZINC000000874830
ZINC000000874832
MFCD04035141
((4AMINOPHENYL)SULFONYL)(OXOLAN2YLMETHYL)AMINE
389605690
4(N(TETRAHYDROFUR2YLMETHYL)SULPHAMOYL)ANILINE
4AMINON(OXOLAN2YLMETHYL)BENZENESULFONAMIDE
4AMINON(TETRAHYDRO2FURANYLMETHYL)BENZENESULFONAMIDE
4AMINON(TETRAHYDROFURAN2YLMETHYL)BENZENESULFONAMIDE
C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)N
InChI=1SC11H16N2O3Sc1293511(649)17(1415)138102171610h361013H127812H2
BBL003737
Synonyms: (2-nitrophenoxy)aceticacid
Smiles: OC(=O)COc1ccccc1[N+](=O)[O-]
OC(=O)COc1ccccc1(N+)(=O)(O)
ONITROPHENOXYACETICACID
ZINC000000043872
ZINC43872
MFCD00016993
(2NITROPHENOXY)ACETICACID
(ONITROPHENOXY)ACETICACID
1878871
2(2NITROPHENOXY)ACETICACID
2NITROPHENOXYACETICACID
ACETICACID(2NITROPHENOXY)
ACETICACID2(2NITROPHENOXY)
C1=CC=C(C(=C1)(N+)(=O)(O))OCC(=O)O
InChI=1SC8H7NO5c108(11)514742136(7)9(12)13h14H5H2(H1011)
BBL003738
Synonyms: 1-(5-amino-2-methylphenyl)pyrrolidin-2-one
Smiles: Nc1ccc(c(c1)N1CCCC1=O)C
Nc1ccc(c(c1)N1CCCC1=O)C
ZINC11920097
1(5AMINO2METHYLPHENYL)2PYRROLIDINONE
1(5AMINO2METHYLPHENYL)PYRROLIDIN2ONE
69131448
CC1=C(C=C(C=C1)N)N2CCCC2=O
InChI=1SC11H14N2Oc18459(12)710(8)1362311(13)14h457H23612H21H3
BBL003739
Synonyms: 5-(3-methylphenyl)-1,3,4-oxadiazole-2-thiol
Smiles: Cc1cccc(c1)c1nnc(o1)S
Cc1cccc(c1)c1nnc(o1)S
MFCD02228636
ZINC000006508911
ZINC6508911
134OXADIAZOLE2(3H)THIONE5(3METHYLPHENYL)
5(3METHYLPHENYL)134OXADIAZOLE2(3H)THIONE(4)
5(3METHYLPHENYL)134OXADIAZOLE2THIOL
5(3METHYLPHENYL)23DIHYDRO134OXADIAZOLE2THIONE
5(3METHYLPHENYL)3H134OXADIAZOLE2THIONE
5(MTOLYL)134OXADIAZOLE2(3H)THIONE
5MTOLYL(134)OXADIAZOLE2THIOL
66147191
CC1=CC=CC(=C1)C2=NNC(=S)O2
InChI=1SC9H8N2OSc163247(56)810119(13)128h25H1H3(H1113)
BBL003740
Synonyms: 1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxylicacid
Smiles: COc1ccc(cc1N1CC(CC1=O)C(=O)O)C
COc1ccc(cc1N1CC(CC1=O)C(=O)O)C
1(2METHOXY5METHYLPHENYL)5OXOPYRROLIDINE3CARBOXYLICACID
793727590
MFCD06364962
ZINC000003445831
ZINC000003445834
CC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)O
InChI=1SC13H15NO4c183411(182)10(58)1479(13(16)17)612(14)15h359H67H212H3(H1617)
BBL003741
Synonyms: N-(methylsulfonyl)glycine
Smiles: OC(=O)CNS(=O)(=O)C
OC(=O)CNS(=O)(=O)C
ZINC2170201
((METHYLSULFONYL)AMINO)ACETICACID
2((METHYLSULFONYL)AMINO)ACETICACID
2(METHANESULFONAMIDO)ACETICACID
2(METHYLSULFONAMIDO)ACETICACID
2METHANESULFONAMIDOACETICACID
35688187
GLYCINEN(METHYLSULFONYL)
METHANESULFONAMIDOACETICACID
METHANESULFONYLAMINOACETICACID
N(METHYLSULFONYL)GLYCINE
CS(=O)(=O)NCC(=O)O
InChI=1SC3H7NO4Sc19(78)423(5)6h4H2H21H3(H56)
BBL003742
Synonyms: 4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Nn1c(S)nnc1c1cccnc1
Nn1c(S)nnc1c1cccnc1
ZINC2228210
4AMINO3(3PYRIDYL)1H124TRIAZOLE5THIONE
4AMINO3(PYRIDIN3YL)45DIHYDRO1H124TRIAZOLE5THIONE
4AMINO3PYRIDIN3YL1H124TRIAZOLE5THIONE
4AMINO5(3PYRIDINYL)4H124TRIAZOLE3THIOL
4AMINO5(3PYRIDYL)124TRIAZOLE3THIOL
4AMINO5(PYRIDIN3YL)124TRIAZOLE3THIOL
4AMINO5(PYRIDIN3YL)24DIHYDRO3H124TRIAZOLE3THIONE
4AMINO5(PYRIDIN3YL)4H(124)TRIAZOLE3THIOL
4AMINO5(PYRIDIN3YL)4H124TRIAZOLE3THIOL
4AMINO5PYRIDIN3YL4H(124)TRIAZOLE3THIOL
4AMINO5PYRIDIN3YL4H124TRIAZOLE3THIOL
78027006
C1=CC(=CN=C1)C2=NNC(=S)N2N
InChI=1SC7H7N5Sc8126(10117(12)13)5213945h14H8H2(H1113)
BBL003743
Synonyms: 4-{[(4-fluorophenyl)sulfonyl]amino}butanoicacid
Smiles: OC(=O)CCCNS(=O)(=O)c1ccc(cc1)F
OC(=O)CCCNS(=O)(=O)c1ccc(cc1)F
ZINC000002899017
ZINC2899017
MFCD02331433
4(((4FLUOROPHENYL)SULFONYL)AMINO)BUTANOICACID
4((4FLUOROPHENYL)SULFONYLAMINO)BUTANOICACID
4(4FLUOROBENZENESULFONAMIDO)BUTANOICACID
4(4FLUOROBENZENESULFONYLAMINO)BUTYRICACID
405919757
C1=CC(=CC=C1F)S(=O)(=O)NCCCC(=O)O
InChI=1SC10H12FNO4Sc118359(648)17(1516)1271210(13)14h3612H127H2(H1314)
BBL003744
Synonyms: 3-(3,4-dimethoxyphenyl)-1H-pyrazole
Smiles: COc1cc(ccc1OC)c1n[nH]cc1
COc1cc(ccc1OC)c1n(nH)cc1
MFCD02091527
ZINC000014807482
ZINC14807482
12DIMETHOXY4PYRAZOL3YLBENZENE
154257702
3(34DIMETHOXYPHENYL)1HPYRAZOLE
3(34DIMETHOXYPHENYL)PYRAZOLE
5(34DIMETHOXYPHENYL)1HPYRAZOLE
COC1=C(C=C(C=C1)C2=CC=NN2)OC
InChI=1SC11H12N2O2c11410438(711(10)152)95612139h37H12H3(H1213)
BBL003745
Synonyms: 3-nitro-4-(phenylamino)benzoicacid
Smiles: [O-][N+](=O)c1cc(ccc1Nc1ccccc1)C(=O)O
(O)(N+)(=O)c1cc(ccc1Nc1ccccc1)C(=O)O
16927494
3NITRO4(PHENYLAMINO)BENZOICACID
3NITRO4(PHENYLAZANIUMYL)BENZOATE
3NITRO4PHENYLAMINOBENZOICACID
4ANILINO3NITROBENZOICACID
4PHENYLAMINO3NITROBENZOICACID
BENZOICACID3NITRO4(PHENYLAMINO)
MFCD00437310
ZINC000003888772
ZINC3888772
C1=CC=C(C=C1)(NH2+)C2=C(C=C(C=C2)C(=O)(O))(N+)(=O)(O)
InChI=1SC13H10N2O4c1613(17)96711(12(89)15(18)19)14104213510h1814H(H1617)
BBL003746
Synonyms: 1-propanoylpiperidine-4-carboxylicacid
Smiles: CCC(=O)N1CCC(CC1)C(=O)O
CCC(=O)N1CCC(CC1)C(=O)O
ZINC52009
117705176
1PROPANOYLPIPERIDINE4CARBOXYLICACID
1PROPIONYL4PIPERIDINECARBOXYLICACID
1PROPIONYLPIPERIDINE4CARBOXYLICACID
InChI=1SC9H15NO3c128(11)10537(4610)9(12)13h7H26H21H3(H1213)
BBL003747
Synonyms: 1-(furan-2-ylcarbonyl)piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)c1ccco1
OC(=O)C1CCN(CC1)C(=O)c1ccco1
ZINC873474
1(2FUROYL)4PIPERIDINECARBOXYLICACID
1(2FUROYL)PIPERIDINE4CARBOXYLICACID
1(FURAN2CARBONYL)PIPERIDINE4CARBOXYLICACID
1(FURAN2YLCARBONYL)PIPERIDINE4CARBOXYLICACID
401581360
C1CN(CCC1C(=O)O)C(=O)C2=CC=CO2
InChI=1SC11H13NO4c1310(9217169)12538(4612)11(14)15h1278H36H2(H1415)
BBL003748
Synonyms: 1-acetylpiperidine-3-carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)C
OC(=O)C1CCCN(C1)C(=O)C
1ACETYL3PIPERIDINECARBOXYLICACID
1ACETYLNIPECOTICACID
1ACETYLPIPERIDINE3CARBOXYLICACID
1NACETYLNIPECOTICACID
1NACETYLPIPERIDINE3CARBOXYLICACID
2637765
3PIPERIDINECARBOXYLICACID1ACETYL
3PIPERIDINECARBOXYLICACID1ACETYL(3R)
3PIPERIDINECARBOXYLICACID1ACETYL(3S)
CC(=O)N1CCCC(C1)C(=O)O
InChI=1SC8H13NO3c16(10)94237(59)8(11)12h7H25H21H3(H1112)
BBL003749
Synonyms: 1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)CCc1c[nH]c2c1cc(F)cc2
OC(=O)C1CC(=O)N(C1)CCc1c(nH)c2c1cc(F)cc2
1(2(5FLUORO1HINDOL3YL)ETHYL)5OXOPYRROLIDINE3CARBOXYLICACID
931374811
C1C(CN(C1=O)CCC2=CNC3=C2C=C(C=C3)F)C(=O)O
InChI=1SC15H15FN2O3c1611121312(611)9(71713)3418810(15(20)21)514(18)19h12671017H358H2(H2021)
BBL003750
Synonyms: N-(dimethylcarbamoyl)glycine
Smiles: CN(C(=O)NCC(=O)O)C
CN(C(=O)NCC(=O)O)C
N((DIMETHYLAMINO)CARBONYL)GLYCINE
N(DIMETHYLCARBAMOYL)GLYCINE
ZINC19092932
((DIMETHYLCARBAMOYL)AMINO)ACETICACID
1060817299
2(33DIMETHYLUREIDO)ACETICACID
2(dimethylcarbamoylamino)aceticacid
CN(C)C(=O)NCC(=O)O
InChI=1SC5H10N2O3c17(2)5(10)634(8)9h3H212H3(H610)(H89)
BBL003751
Synonyms: [methyl(phenyl)amino](oxo)aceticacid
Smiles: CN(C(=O)C(=O)O)c1ccccc1
CN(C(=O)C(=O)O)c1ccccc1
OXAMICACIDESTER24
ZINC19092767
(METHYL(PHENYL)AMINO)(OXO)ACETICACID
(METHYL(PHENYL)CARBAMOYL)FORMICACID
13120337
2(METHYL(PHENYL)AMINO)2OXOACETICACID
2(Nmethylanilino)2oxoaceticacid
CN(C1=CC=CC=C1)C(=O)C(=O)O
InChI=1SC9H9NO3c110(8(11)9(12)13)7532467h26H1H3(H1213)
BBL003752
Synonyms: [(2-ethylphenyl)amino](oxo)aceticacid
Smiles: CCc1ccccc1NC(=O)C(=O)O
CCc1ccccc1NC(=O)C(=O)O
N(2ETHYLPHENYL)METHANECARBOXYLICACID
ZINC2786946
((2ETHYLPHENYL)AMINO)(OXO)ACETICACID
((2ETHYLPHENYL)CARBAMOYL)FORMICACID
2((2ETHYLPHENYL)AMINO)2OXOACETICACID
2(2ETHYLANILINO)2OXOACETICACID
50740380
CCC1=CC=CC=C1NC(=O)C(=O)O
InChI=1SC10H11NO3c12753468(7)119(12)10(13)14h36H2H21H3(H1112)(H1314)
BBL003753
Synonyms: (2-methylpiperidin-1-yl)(oxo)aceticacid
Smiles: CC1CCCCN1C(=O)C(=O)O
CC1CCCCN1C(=O)C(=O)O
(2METHYL1PIPERIDINYL)(OXO)ACETICACID
(2METHYLPIPERIDIN1YL)(OXO)ACETICACID
1PIPERIDINEACETICACID2METHYLAOXO
2(2METHYLPIPERIDIN1YL)2OXOACETICACID
77654616
MFCD09971294
OXAMICACIDESTER33
ZINC000019092846
ZINC000019092848
InChI=1SC8H13NO3c1642359(6)7(10)8(11)12h6H25H21H3(H1112)
BBL003754
Synonyms: [(3-fluorophenyl)amino](oxo)aceticacid
Smiles: Fc1cccc(c1)NC(=O)C(=O)O
Fc1cccc(c1)NC(=O)C(=O)O
87967279
((3FLUOROPHENYL)AMINO)(OXO)ACETICACID
((3FLUOROPHENYL)CARBAMOYL)FORMICACID
2((3FLUOROPHENYL)AMINO)2OXOACETICACID
ZINC19091955
2(3fluoroanilino)2oxoaceticacid
C1=CC(=CC(=C1)F)NC(=O)C(=O)O
InChI=1SC8H6FNO3c952136(45)107(11)8(12)13h14H(H1011)(H1213)
BBL003755
Synonyms: [(2,3-dimethylphenyl)amino](oxo)aceticacid
Smiles: Cc1c(NC(=O)C(=O)O)cccc1C
Cc1c(NC(=O)C(=O)O)cccc1C
959241066
((23DIMETHYLPHENYL)AMINO)(OXO)ACETICACID
((23DIMETHYLPHENYL)CARBAMOYL)FORMICACID
2((23DIMETHYLPHENYL)AMINO)2OXOACETICACID
MFCD09864574
ZINC000019092686
ZINC19092686
2(23dimethylanilino)2oxoaceticacid
CC1=C(C(=CC=C1)NC(=O)C(=O)O)C
InChI=1SC10H11NO3c164358(7(6)2)119(12)10(13)14h35H12H3(H1112)(H1314)
BBL003756
Synonyms: 4-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide
Smiles: Cc1nnc(s1)NC(=O)CCCCl
Cc1nnc(s1)NC(=O)CCCCl
ZINC06223779
ZINC6223779
392244449
4CHLORON(5METHYL134THIADIAZOL2YL)BUTANAMIDE
BUTANAMIDE4CHLORON(5METHYL134THIADIAZOL2YL)
CC1=NN=C(S1)NC(=O)CCCCl
InChI=1SC7H10ClN3OSc1510117(135)96(12)3248h24H21H3(H91112)
BBL003757
Synonyms: 4-chloro-N-(4-cyanophenyl)butanamide
Smiles: ClCCCC(=O)Nc1ccc(cc1)C#N
ClCCCC(=O)Nc1ccc(cc1)C#N
1016674126
4CHLORON(4CYANOPHENYL)BUTANAMIDE
ZINC19092675
C1=CC(=CC=C1C#N)NC(=O)CCCCl
InChI=1SC11H11ClN2Oc1271211(15)1410539(813)4610h36H127H2(H1415)
BBL003758
Synonyms: 4-chloro-N-(1,3,4-thiadiazol-2-yl)butanamide
Smiles: ClCCCC(=O)Nc1nncs1
ClCCCC(=O)Nc1nncs1
ZINC06343117
ZINC6343117
4CHLORON(134THIADIAZOL2YL)BUTANAMIDE
4CHLORON134THIADIAZOL2YLBUTANAMIDE
4CHLORONBUTANAMIDE
544700563
C1=NN=C(S1)NC(=O)CCCCl
InChI=1SC6H8ClN3OSc73125(11)961084126h4H13H2(H91011)
BBL003759
Synonyms: [(2,4-difluorophenyl)amino](oxo)aceticacid
Smiles: Fc1ccc(c(c1)F)NC(=O)C(=O)O
Fc1ccc(c(c1)F)NC(=O)C(=O)O
N(24DIFLUOROPHENYL)METHANECARBOXYLICACID
ZINC2796995
((24DIFLUOROPHENYL)AMINO)(OXO)ACETICACID
((24DIFLUOROPHENYL)CARBAMOYL)FORMICACID
2((24DIFLUOROPHENYL)AMINO)2OXOACETICACID
2(24DIFLUOROANILINO)2OXOACETICACID
678556815
C1=CC(=C(C=C1F)F)NC(=O)C(=O)O
InChI=1SC8H5F2NO3c94126(5(10)34)117(12)8(13)14h13H(H1112)(H1314)
BBL003760
Synonyms: [(3,5-difluorophenyl)amino](oxo)aceticacid
Smiles: O=C(C(=O)O)Nc1cc(F)cc(c1)F
O=C(C(=O)O)Nc1cc(F)cc(c1)F
ZINC19093171
((35DIFLUOROPHENYL)AMINO)(OXO)ACETICACID
((35DIFLUOROPHENYL)CARBAMOYL)FORMICACID
1060817539
2((35DIFLUOROPHENYL)AMINO)2OXOACETICACID
2(35difluoroanilino)2oxoaceticacid
C1=C(C=C(C=C1F)F)NC(=O)C(=O)O
InChI=1SC8H5F2NO3c9415(10)36(24)117(12)8(13)14h13H(H1112)(H1314)
BBL003761
Synonyms: (2-methyl-2,3-dihydro-1H-indol-1-yl)(oxo)aceticacid
Smiles: CC1Cc2c(N1C(=O)C(=O)O)cccc2
CC1Cc2c(N1C(=O)C(=O)O)cccc2
2(2METHYLINDOLIN1YL)2OXOACETICACID
(2METHYL23DIHYDRO1HINDOL1YL)(OXO)ACETICACID
(2METHYL23DIHYDROINDOL1YL)(OXO)ACETICACID
1018295367
MFCD10018504
ZINC000019093104
ZINC000019093106
2(2methyl23dihydroindol1yl)2oxoaceticacid
CC1CC2=CC=CC=C2N1C(=O)C(=O)O
InChI=1SC11H11NO3c176842359(8)12(7)10(13)11(14)15h257H6H21H3(H1415)
BBL003762
Synonyms: 3,4-dihydroquinolin-1(2H)-yl(oxo)aceticacid
Smiles: OC(=O)C(=O)N1CCCc2c1cccc2
OC(=O)C(=O)N1CCCc2c1cccc2
ZINC19093150
1018565995
2(34DIHYDROQUINOLIN1(2H)YL)2OXOACETICACID
34DIHYDRO1(2H)QUINOLINYL(OXO)ACETICACID
34DIHYDRO2HQUINOLIN1YL(OXO)ACETICACID
34DIHYDROQUINOLIN1(2H)YL(OXO)ACETICACID
2(34dihydro2Hquinolin1yl)2oxoaceticacid
C1CC2=CC=CC=C2N(C1)C(=O)C(=O)O
InChI=1SC11H11NO3c1310(11(14)15)12735841269(8)12h1246H357H2(H1415)
BBL003763
Synonyms: 2,3-dihydro-1H-indol-1-yl(oxo)aceticacid
Smiles: OC(=O)C(=O)N1CCc2c1cccc2
OC(=O)C(=O)N1CCc2c1cccc2
ZINC19092902
1018243087
2(INDOLIN1YL)2OXOACETICACID
23DIHYDRO1HINDOL1YL(OXO)ACETICACID
23DIHYDROINDOL1YL(OXO)ACETICACID
2(23dihydroindol1yl)2oxoaceticacid
C1CN(C2=CC=CC=C21)C(=O)C(=O)O
InChI=1SC10H9NO3c129(10(13)14)1165731248(7)11h14H56H2(H1314)
BBL003764
Synonyms: [(2-methylbutan-2-yl)amino](oxo)aceticacid
Smiles: CCC(NC(=O)C(=O)O)(C)C
CCC(NC(=O)C(=O)O)(C)C
2OXO2(TERTPENTYLAMINO)ACETICACID
((11DIMETHYLPROPYL)AMINO)(OXO)ACETICACID
((2METHYLBUTAN2YL)AMINO)(OXO)ACETICACID
((2METHYLBUTAN2YL)CARBAMOYL)FORMICACID
1015846691
MFCD09971299
ZINC000019092890
ZINC19092890
2(2methylbutan2ylamino)2oxoaceticacid
CCC(C)(C)NC(=O)C(=O)O
InChI=1SC7H13NO3c147(23)85(9)6(10)11h4H213H3(H89)(H1011)
BBL003765
Synonyms: oxo(1,3,4-thiadiazol-2-ylamino)aceticacid
Smiles: OC(=O)C(=O)Nc1nncs1
OC(=O)C(=O)Nc1nncs1
OXO(134THIADIAZOL2YLAMINO)ACETICACID
ZINC19092070
((134THIADIAZOL2YL)CARBAMOYL)FORMICACID
130992200
2((134THIADIAZOL2YL)AMINO)2OXOACETICACID
2(134THIADIAZOL2YLAMINO)2OXOACETICACID
ACETICACID2OXO2(134THIADIAZOL2YLAMINO)
ACETICACIDOXO
BBL003766
Synonyms: [(5-methyl-1,2-oxazol-3-yl)amino](oxo)aceticacid
Smiles: Cc1cc(no1)NC(=O)C(=O)O
Cc1cc(no1)NC(=O)C(=O)O
2((5METHYLISOXAZOL3YL)AMINO)2OXOACETICACID
91933549
((5METHYL12OXAZOL3YL)AMINO)(OXO)ACETICACID
((5METHYL12OXAZOL3YL)CARBAMOYL)FORMICACID
((5METHYL3ISOXAZOLYL)AMINO)(OXO)ACETICACID
((5METHYLISOXAZOL3YL)AMINO)(OXO)ACETICACID
N(5METHYLISOXAZOL3YL)OXAMIDICACID
ZINC19092036
2((5methyl12oxazol3yl)amino)2oxoaceticacid
CC1=CC(=NO1)NC(=O)C(=O)O
InChI=1SC6H6N2O4c1324(8123)75(9)6(10)11h2H1H3(H1011)(H789)
BBL003767
Synonyms: [(5-ethyl-1,3,4-thiadiazol-2-yl)amino](oxo)aceticacid
Smiles: CCc1nnc(s1)NC(=O)C(=O)O
CCc1nnc(s1)NC(=O)C(=O)O
ZINC19092222
((5ETHYL134THIADIAZOL2YL)AMINO)(OXO)ACETICACID
((5ETHYL134THIADIAZOL2YL)CARBAMOYL)FORMICACID
2((5ETHYL134THIADIAZOL2YL)AMINO)2OXOACETICACID
83244820
CCC1=NN=C(S1)NC(=O)C(=O)O
InChI=1SC6H7N3O3Sc123896(133)74(10)5(11)12h2H21H3(H1112)(H7910)
BBL003768
Synonyms: [(5-methyl-1,3,4-thiadiazol-2-yl)amino](oxo)aceticacid
Smiles: Cc1nnc(s1)NC(=O)C(=O)O
Cc1nnc(s1)NC(=O)C(=O)O
ZINC19091924
((5METHYL134THIADIAZOL2YL)AMINO)(OXO)ACETICACID
((5METHYL134THIADIAZOL2YL)CARBAMOYL)FORMICACID
2((5METHYL134THIADIAZOL2YL)AMINO)2OXOACETICACID
83244819
CC1=NN=C(S1)NC(=O)C(=O)O
InChI=1SC5H5N3O3Sc12785(122)63(9)4(10)11h1H3(H1011)(H689)
BBL003769
Synonyms: 3,4-dihydroisoquinolin-2(1H)-yl(oxo)aceticacid
Smiles: OC(=O)C(=O)N1CCc2c(C1)cccc2
OC(=O)C(=O)N1CCc2c(C1)cccc2
ZINC13512834
2(34DIHYDRO1HISOQUINOLIN2YL)2OXOACETICACID
2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOACETICACID
2ISOQUINOLINEACETICACID34DIHYDROALPHAOXO
34DIHYDRO1HISOQUINOLIN2YL(OXO)ACETICACID
34DIHYDROISOQUINOLIN2(1H)YL(OXO)ACETICACID
603097445
C1CN(CC2=CC=CC=C21)C(=O)C(=O)O
InChI=1SC11H11NO3c1310(11(14)15)1265831249(8)712h14H57H2(H1415)
BBL003770
Synonyms: 1-propanoylpiperidine-3-carboxylicacid
Smiles: CCC(=O)N1CCCC(C1)C(=O)O
CCC(=O)N1CCCC(C1)C(=O)O
1PROPANOYLPIPERIDINE3CARBOXYLICACID
1PROPIONYL3PIPERIDINECARBOXYLICACID
1PROPIONYLPIPERIDINE3CARBOXYLICACID
926246539
InChI=1SC9H15NO3c128(11)105347(610)9(12)13h7H26H21H3(H1213)
BBL003771
Synonyms: 2-chloro-N-cyclopentylpropanamide
Smiles: CC(C(=O)NC1CCCC1)Cl
CC(C(=O)NC1CCCC1)Cl
2CHLORONCYCLOPENTYLPROPANAMIDE
565180190
InChI=1SC8H14ClNOc16(9)8(11)10742357h67H25H21H3(H1011)
BBL003772
Synonyms: 1-(azepan-1-yl)-2-chloropropan-1-one
Smiles: CC(C(=O)N1CCCCCC1)Cl
CC(C(=O)N1CCCCCC1)Cl
1(2CHLOROPROPANOYL)AZEPANE
1(AZEPAN1YL)2CHLOROPROPAN1ONE
115840341
1PROPANONE2CHLORO1(HEXAHYDRO1HAZEPIN1YL)
InChI=1SC9H16ClNOc18(10)9(12)1164235711h8H27H21H3
BBL003773
Synonyms: 2-chloro-N-(1,3,4-thiadiazol-2-yl)propanamide
Smiles: CC(C(=O)Nc1nncs1)Cl
CC(C(=O)Nc1nncs1)Cl
1019456177
2CHLORON(134THIADIAZOL2YL)PROPANAMIDE
2CHLORON134THIADIAZOL2YLPROPANAMIDE
CC(C(=O)NC1=NN=CS1)Cl
InChI=1SC5H6ClN3OSc13(6)4(10)85972115h23H1H3(H8910)
BBL003774
Synonyms: 6-amino-5-bromo-1-methylpyrimidine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c(=O)c(c(n1C)N)Br
O=c1(nH)c(=O)c(c(n1C)N)Br
ZINC01569828
ZINC1569828
6AMINO5BROMO1METHYL13DIHYDROPYRIMIDINE24DIONE
6AMINO5BROMO1METHYL24(1H3H)PYRIMIDINEDIONE
6AMINO5BROMO1METHYL3HPYRIMIDINE24DIONE
6AMINO5BROMO1METHYLPYRIMIDINE24(1H3H)DIONE
6AMINO5BROMO1METHYLPYRIMIDINE24DIONE
6AMINO5BROMO1METHYLURACIL
14094372
1METHYL5BROMO6AMINOURACIL
24(1H3H)PYRIMIDINEDIONE6AMINO5BROMO1METHYL
CN1C(=C(C(=O)NC1=O)Br)N
InChI=1SC5H6BrN3O2c193(7)2(6)4(10)85(9)11h7H21H3(H81011)
BBL003775
Synonyms: 4-{[(4-methoxyphenyl)sulfonyl]amino}butanoicacid
Smiles: COc1ccc(cc1)S(=O)(=O)NCCCC(=O)O
COc1ccc(cc1)S(=O)(=O)NCCCC(=O)O
MFCD02331432
ZINC000001902848
ZINC1902848
4(((4METHOXYPHENYL)SULFONYL)AMINO)BUTANOICACID
4((4METHOXYPHENYL)SULFONYLAMINO)BUTANOICACID
4(4METHOXYBENZENESULFONAMIDO)BUTANOICACID
4(4METHOXYBENZENESULFONYLAMINO)BUTYRICACID
81242264
BUTANOICACID4(((4METHOXYPHENYL)SULFONYL)AMINO)
COC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)O
InChI=1SC11H15NO5Sc11794610(759)18(1516)1282311(13)14h4712H238H21H3(H1314)
BBL003776
Synonyms: 3-[(3-methylbenzyl)sulfanyl]propan-1-amine
Smiles: NCCCSCc1cccc(c1)C
NCCCSCc1cccc(c1)C
ZINC21953347
1082766377
3(((3METHYLPHENYL)METHYL)SULFANYL)PROPAN1AMINE
3((3METHYLBENZYL)SULFANYL)PROPAN1AMINE
3((3METHYLBENZYL)THIO)1PROPANAMINE
3((3methylphenyl)methylsulfanyl)propan1amine
CC1=CC(=CC=C1)CSCCCN
InChI=1SC11H17NSc11042511(810)91373612h2458H367912H21H3
BBL003777
Synonyms: pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Smiles: O=c1[nH]ccc2c1cnc1n2ncn1
O=c1(nH)ccc2c1cnc1n2ncn1
pyrido(34e)(124)triazolo(15a)pyrimidin6(7H)one
932233335
BBL003778
Synonyms: 3-[(2-fluorobenzyl)sulfanyl]propan-1-amine
Smiles: NCCCSCc1ccccc1F
NCCCSCc1ccccc1F
ZINC29866065
1123169594
3(((2FLUOROPHENYL)METHYL)SULFANYL)PROPAN1AMINE
3((2FLUOROBENZYL)SULFANYL)PROPAN1AMINE
3((2FLUOROBENZYL)THIO)1PROPANAMINE
3((2FLUOROBENZYL)THIO)PROPAN1AMINE
3((2fluorophenyl)methylsulfanyl)propan1amine
C1=CC=C(C(=C1)CSCCCN)F
InChI=1SC10H14FNSc111052149(10)81373612h1245H36812H2
BBL003779
Synonyms: N-(4-fluorobenzyl)-N-methylglycine
Smiles: CN(Cc1ccc(cc1)F)CC(=O)O
CN(Cc1ccc(cc1)F)CC(=O)O
947013867
((4FLUOROBENZYL)METHYLAMINO)ACETICACID
2(((4FLUOROPHENYL)METHYL)(METHYL)AMINO)ACETIC
2((4FLUOROBENZYL)(METHYL)AMINO)ACETICACID
N(4FLUOROBENZYL)NMETHYLGLYCINE
ZINC13495663
2((4fluorophenyl)methylmethylazaniumyl)acetate
C(NH+)(CC1=CC=C(C=C1)F)CC(=O)(O)
InChI=1SC10H12FNO2c112(710(13)14)68249(11)538h25H67H21H3(H1314)
BBL003780
Synonyms: 1-(5-chloro-2-methoxyphenyl)-1H-pyrrole-2,5-dione
Smiles: COc1ccc(cc1N1C(=O)C=CC1=O)Cl
COc1ccc(cc1N1C(=O)C=CC1=O)Cl
MFCD00176573
ZINC000000102341
ZINC00102341
ZINC102341
1(5CHLORO2METHOXYPHENYL)1HPYRROLE25DIONE
1(5CHLORO2METHOXYPHENYL)AZOLINE25DIONE
1(5CHLORO2METHOXYPHENYL)PYRROLE25DIONE
1HPYRROLE25DIONE1(5CHLORO2METHOXYPHENYL)
39900817
COC1=C(C=C(C=C1)Cl)N2C(=O)C=CC2=O
InChI=1SC11H8ClNO3c1169327(12)68(9)1310(14)4511(13)15h26H1H3
BBL003781
Synonyms: 3-[(4-methylphenyl)sulfanyl]propan-1-amine
Smiles: NCCCSc1ccc(cc1)C
NCCCSc1ccc(cc1)C
ZINC1714517
1((3AMINOPROPYL)SULFANYL)4METHYLBENZENE
3((4METHYLPHENYL)SULFANYL)PROPAN1AMINE
3((4METHYLPHENYL)THIO)1PROPANAMINE
3(4METHYLPHENYL)SULFANYLPROPAN1AMINE
3(4METHYLPHENYLTHIO)PROPYLAMINE
3(PTOLYLTHIO)PROPAN1AMINE
67215172
CC1=CC=C(C=C1)SCCCN
InChI=1SC10H15NSc193510(649)1282711h36H27811H21H3
BBL003782
Synonyms: 3-(cyclohexylsulfanyl)propan-1-amine
Smiles: NCCCSC1CCCCC1
NCCCSC1CCCCC1
ZINC19093345
((3AMINOPROPYL)SULFANYL)CYCLOHEXANE
3(CYCLOHEXYLSULFANYL)PROPAN1AMINE
3(CYCLOHEXYLTHIO)1PROPANAMINE
3cyclohexylsulfanylpropan1amine
C1CCC(CC1)SCCCN
InChI=1SC9H19NSc10748119521369h9H1810H2
BBL003783
Synonyms: N-methyl-N-(4-methylbenzyl)glycine
Smiles: CN(Cc1ccc(cc1)C)CC(=O)O
CN(Cc1ccc(cc1)C)CC(=O)O
NMETHYLN(4METHYLBENZYL)GLYCINE
ZINC19093370
(METHYL(4METHYLBENZYL)AMINO)ACETICACID
1041538082
2(METHYL((4METHYLPHENYL)METHYL)AMINO)ACETICACID
2(METHYL(4METHYLBENZYL)AMINO)ACETICACID
CC1=CC=C(C=C1)CN(C)CC(=O)O
InChI=1SC11H15NO2c193510(649)712(2)811(13)14h36H78H212H3(H1314)
BBL003784
Synonyms: 2-benzylbutan-1-amine
Smiles: CCC(Cc1ccccc1)CN
CCC(Cc1ccccc1)CN
(2BENZYLBUTYL)AMINE
1017145797
2BENZYLBUTAN1AMINE
2ETHYL3PHENYLPROPYLAMINE
CCC(CC1=CC=CC=C1)CN
InChI=1SC11H17Nc1210(912)8116435711h3710H28912H21H3
BBL003785
Synonyms: 6-methoxy-2,2-dimethyl-3,4-dihydro-2H-chromen-4-amine
Smiles: COc1ccc2c(c1)C(N)CC(O2)(C)C
COc1ccc2c(c1)C(N)CC(O2)(C)C
6METHOXY22DIMETHYLCHROMAN4AMINE
752184513
(6METHOXY22DIMETHYL34DIHYDRO2HCHROMEN4YL)AMINE
6METHOXY22DIMETHYL34DIHYDRO2H1BENZOPYRAN4
6METHOXY22DIMETHYL34DIHYDRO2HCHROMEN4AMINE
6methoxy22dimethyl34dihydrochromen4amine
CC1(CC(C2=C(O1)C=CC(=C2)OC)N)C
InChI=1SC12H17NO2c112(2)710(13)968(143)4511(9)1512h4610H713H213H3
BBL003786
Synonyms: 1-(3,4-dimethoxyphenyl)propan-1-amine
Smiles: CCC(c1ccc(c(c1)OC)OC)N
CCC(c1ccc(c(c1)OC)OC)N
1(34DIMETHOXYPHENYL)1PROPANAMINE
1(34DIMETHOXYPHENYL)1PROPANAMINEX1HCL
1(34DIMETHOXYPHENYL)PROPAN1AMINE
1(34DIMETHOXYPHENYL)PROPYLAMINE
101589213
BENZENEMETHANAMINEAETHYL34DIMETHOXY
CCC(C1=CC(=C(C=C1)OC)OC)N
InChI=1SC11H17NO2c149(12)85610(132)11(78)143h579H412H213H3
BBL003787
Synonyms: 1,1'-disulfanediylbis(4-chloro-2-nitrobenzene)
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])SSc1ccc(cc1[N+](=O)[O-])Cl
Clc1ccc(c(c1)(N+)(=O)(O))SSc1ccc(cc1(N+)(=O)(O))Cl
DI(4CHLORO2NITROPHENYL)DISULPHIDE
DI4CHLORO2NITROPHENYLDISULFIDE
DISULFIDEBIS(4CHLORO2NITROPHENYL)
ZINC01693408
ZINC1693408
11DISULFANEDIYLBIS(4CHLORO2NITROBENZENE)
2050660
22DINITRO44DICHLORODIPHENYLDISUFIDE
22DINITRO44DICHLORODIPHENYLDISULFIDE
44DICHLORO22DINITRODIPHENYLDISULFIDE
4CHLORO1((4CHLORO2NITROPHENYL)DISULFANYL)2NITROBENZENE
4CHLORO1((4CHLORO2NITROPHENYL)DITHIO)2NITROBENZENE
4CHLORO2NITROPHENYLDISULFIDE
BIS(2NITRO4CHLOROPHENYL)DISULFIDE
BIS(2NITRO4CHLOROPHENYL)PERSULFIDE
BIS(4CHLORO2NITROPHENYL)DISULFIDE
BIS(4CHLORO2NITROPHENYL)DISULPHIDE
C1=CC(=C(C=C1Cl)(N+)(=O)(O))SSC2=C(C=C(C=C2)Cl)(N+)(=O)(O)
InChI=1SC12H6Cl2N2O4S2c1371311(9(57)15(17)18)212212428(14)610(12)16(19)20h16H
BBL003788
Synonyms: 2-methyl-4,5-diphenyl-1,3-thiazole
Smiles: Cc1nc(c(s1)c1ccccc1)c1ccccc1
Cc1nc(c(s1)c1ccccc1)c1ccccc1
2METHYL45DIPHENYL13THIAZOLE
2METHYL45DIPHENYLTHIAZOLE
3755837
45DIPHENYL2METHYLTHIAZOLE
MFCD00186396
THIAZOLE2METHYL45DIPHENYL
ZINC000000157399
ZINC00157399
ZINC157399
CC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3
InChI=1SC16H13NSc1121715(138425913)16(1812)14106371114h211H1H3
BBL003789
Synonyms: 1-[(2,4,6-trimethylphenyl)sulfonyl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(cc1C)C
OC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(cc1C)C
ZINC3865029
1((246TRIMETHYLPHENYL)SULFONYL)PIPERIDINE4CARBOXYLICACID
1(246TRIMETHYLPHENYL)SULFONYLPIPERIDINE4CARBOXYLICACID
1(246TRIMETHYLPHENYLSULFONYL)PIPERIDINE4CARBOXYLICACID
1(MESITYLSULFONYL)PIPERIDINE4CARBOXYLICACID
394245693
CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)O)C
InChI=1SC15H21NO4Sc110811(2)14(12(3)910)21(1920)166413(5716)15(17)18h8913H47H213H3(H1718)
BBL003790
Synonyms: 4-(piperidin-1-yl)-1,3,5-triazin-2-amine
Smiles: Nc1ncnc(n1)N1CCCCC1
Nc1ncnc(n1)N1CCCCC1
ZINC14291092
32330920
4(1PIPERIDINYL)135TRIAZIN2AMINE
4(PIPERIDIN1YL)135TRIAZIN2AMINE
4PIPERIDIN1YL(135)TRIAZIN2YLAMINE
4PIPERIDIN1YL135TRIAZIN2AMINE
4PIPERIDYL135TRIAZINE2YLAMINE
C1CCN(CC1)C2=NC(=NC=N2)N
InChI=1SC8H13N5c97106118(127)134213513h6H15H2(H29101112)
BBL003791
Synonyms: 1,3-dimethyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Smiles: O=C1C(C)NC(=O)c2c(N1C)cccc2
O=C1C(C)NC(=O)c2c(N1C)cccc2
13DIMETHYL34DIHYDRO14BENZODIAZEPINE25DIONE
13DIMETHYL34DIHYDRO1H(14)BENZODIAZEPINE25DIONE
13DIMETHYL34DIHYDRO1H14BENZODIAZEPINE25DIONE
13DIMETHYL34DIHYDRO1HBENZO(E)(14)DIAZEPINE25DIONE
13DIMETHYL3H4HBENZO(F)14DIAZAPERHYDROEPINE25DIONE
1H14BENZODIAZEPINE25DIONE34DIHYDRO13DIMETHYL
5973239
CC1C(=O)N(C2=CC=CC=C2C(=O)N1)C
InChI=1SC11H12N2O2c1711(15)13(2)964358(9)10(14)127h37H12H3(H1214)
BBL003792
Synonyms: 1-(2-methylphenyl)-1-phenylmethanamine
Smiles: Cc1ccccc1C(c1ccccc1)N
Cc1ccccc1C(c1ccccc1)N
(2METHYLPHENYL)(PHENYL)METHANAMINE
1(2METHYLPHENYL)1PHENYLMETHANAMINE
2936621
ALPHA(2METHYLPHENYL)BENZENEMETHANEAMINE
PHENYL(OTOLYL)METHANAMINE
(2methylphenyl)phenylmethanamine
CC1=CC=CC=C1C(C2=CC=CC=C2)N
InChI=1SC14H15Nc1117561013(11)14(15)128324912h21014H15H21H3
BBL003793
Synonyms: 2-methyl-3-(naphthalen-1-yl)propan-1-amine
Smiles: NCC(Cc1cccc2c1cccc2)C
NCC(Cc1cccc2c1cccc2)C
1123169447
2METHYL3(1NAPHTHYL)1PROPANAMINE
2METHYL3(NAPHTHALEN1YL)PROPAN1AMINE
2methyl3naphthalen1ylpropan1amine
CC(CC1=CC=CC2=CC=CC=C21)CN
InChI=1SC14H17Nc111(1015)91374612523814(12)13h2811H91015H21H3
BBL003794
Synonyms: 1-[4-(methylsulfonyl)phenyl]propan-1-amine
Smiles: CCC(c1ccc(cc1)S(=O)(=O)C)N
CCC(c1ccc(cc1)S(=O)(=O)C)N
889937013
1(4(METHYLSULFONYL)PHENYL)1PROPANAMINE
1(4(METHYLSULFONYL)PHENYL)PROPAN1AMINE
1(4METHANESULFONYLPHENYL)PROPAN1AMINE
1(4methylsulfonylphenyl)propan1amine
CCC(C1=CC=C(C=C1)S(=O)(=O)C)N
InChI=1SC10H15NO2Sc1310(11)8469(758)14(212)13h4710H311H212H3
BBL003795
Synonyms: 5-(3-aminopropyl)-1,3,4-thiadiazol-2-amine
Smiles: NCCCc1nnc(s1)N
NCCCc1nnc(s1)N
ZINC20206031
182125231
5(3AMINOPROPYL)134THIADIAZOL2AMINE
5AMINO134THIADIAZOLE2PROPANAMINE
BBL003796
Synonyms: 3-amino-N-phenylbenzenesulfonamide
Smiles: Nc1cccc(c1)S(=O)(=O)Nc1ccccc1
Nc1cccc(c1)S(=O)(=O)Nc1ccccc1
ZINC000004362787
ZINC04362787
ZINC4362787
MAMINOBENZENESULFONANILIDE
MAMINOBENZENESULPHONANILIDE
METANILANILIDE
METANILANILIDE(8CI)
MFCD00035928
((3AMINOPHENYL)SULFONYL)PHENYLAMINE
3AMINOBENZENESULFONANILIDE
3AMINOBENZENESULPHONANILIDE
3AMINONPHENYLBENZENE1SULFONAMIDE
3AMINONPHENYLBENZENESULFONAMIDE
80217
BENZENESULFONAMIDE3AMINONPHENYL
BENZENESULFONANILIDE3AMINO
C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)N
InChI=1SC12H12N2O2Sc131054812(910)17(1516)14116213711h1914H13H2
BBL003797
Synonyms: N-(3-fluorophenyl)-1,3,5-triazine-2,4-diamine
Smiles: Fc1cccc(c1)Nc1ncnc(n1)N
Fc1cccc(c1)Nc1ncnc(n1)N
(4AMINO(135TRIAZIN2YL))(3FLUOROPHENYL)AMINE
19079380
2AMINO4(3FLUOROPHENYLAMINO)135TRIAZINE
2N(3FLUOROPHENYL)135TRIAZINE24DIAMINE
MFCD00203535
N(3FLUOROPHENYL)(135)TRIAZINE24DIAMINE
N(3FLUOROPHENYL)135TRIAZINE24DIAMINE
N2(3FLUOROPHENYL)135TRIAZINE24DIAMINE
ZINC000000089558
ZINC00089558
ZINC89558
C1=CC(=CC(=C1)F)NC2=NC=NC(=N2)N
InChI=1SC9H8FN5c1062137(46)149135128(11)159h15H(H31112131415)
BBL003798
Synonyms: 2-(pyridin-3-yl)-1,3-benzothiazole
Smiles: c1ccc(cn1)c1nc2c(s1)cccc2
c1ccc(cn1)c1nc2c(s1)cccc2
MFCD00579075
ZINC000000235981
ZINC00235981
ZINC235981
2(3PYRIDINYL)13BENZOTHIAZOLE
2(3PYRIDINYL)BENZOTHIAZOLE
2(3PYRIDYL)BENZOTHIAZOLE
2(PYRIDIN3YL)13BENZOTHIAZOLE
2612728
2PYRIDIN3YL13BENZOTHIAZOLE
2PYRIDIN3YLBENZOTHIAZOLE
BENZO(D)THIAZOLE2(PYRIDIN3YL)
BENZOTHIAZOLE2(3PYRIDINYL)
BENZOTHIAZOLE2(3PYRIDYL)
C1=CC=C2C(=C1)N=C(S2)C3=CN=CC=C3
InChI=1SC12H8N2Sc1261110(51)1412(1511)94371389h18H
BBL003799
Synonyms: 2,2,7-trimethyl-3,4-dihydro-2H-chromen-4-amine
Smiles: Cc1ccc2c(c1)OC(CC2N)(C)C
Cc1ccc2c(c1)OC(CC2N)(C)C
(227TRIMETHYL34DIHYDRO2HCHROMEN4YL)AMINE
112225657
227TRIMETHYL34DIHYDRO2H1BENZOPYRAN4
227TRIMETHYL34DIHYDRO2HCHROMEN4AMINE
227trimethyl34dihydrochromen4amine
CC1=CC2=C(C=C1)C(CC(O2)(C)C)N
InChI=1SC12H17NOc1845910(13)712(23)1411(9)68h4610H713H213H3
BBL003800
Synonyms: 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)C(N)C
Nc1nnc(s1)C(N)C
5(1AMINOETHYL)134THIADIAZOL2AMINE
CC(C1=NN=C(S1)N)N
InChI=1SC4H8N4Sc12(5)3784(6)93h2H5H21H3(H268)
BBL003801
Synonyms: 5-oxo-1-(4-sulfophenyl)-4,5-dihydro-1H-pyrazole-3-carboxylicacid
Smiles: O=C1CC(=NN1c1ccc(cc1)S(=O)(=O)O)C(=O)O
O=C1CC(=NN1c1ccc(cc1)S(=O)(=O)O)C(=O)O
PYRAZOLONET
ZINC000004012812
ZINC4012812
MFCD00020755
118478
1HPYRAZOLE3CARBOXYLICACID45DIHYDRO5OXO1(4SULFOPHENYL)
1HPYRAZOLE3CARBOXYLICACID5DIHYDRO5OXO1(4SULFOPHENYL)
2PYRAZOLINE3CARBOXYLICACID5OXO1(PSULFOPHENYL)
2PYRAZOLINE3CARBOXYLICACID5OXO1(PSULFOPHENYL)(6CI7CI8CI)
45DIHYDRO5OXO1(4SULFOPHENYL)1HPYRAZOLE3CARBOXYLICACID
5OXO1(4SULFOPHENYL)2PYRAZOLINE3CARBOXYLICACID
5OXO1(4SULFOPHENYL)45DIHYDRO1HPYRAZOLE3CARBOXYLICACID
5OXO1(4SULFOPHENYL)4HPYRAZOLE3CARBOXYLICACID
5OXO1(4SULPHOPHENYL)2PYRAZOLINE3CARBOXYLICACID
C1C(=NN(C1=O)C2=CC=C(C=C2)S(=O)(=O)O)C(=O)O
InChI=1SC10H8N2O6Sc13958(10(14)15)1112(9)6137(426)19(1617)18h14H5H2(H1415)(H161718)
BBL003802
Synonyms: 4-(2,3-dihydro-1H-indol-1-ylmethyl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)CN1CCc2c1cccc2
OC(=O)c1ccc(cc1)CN1CCc2c1cccc2
ZINC11852021
4(23DIHYDRO1HINDOL1YLMETHYL)BENZOICACID
938146997
4(23dihydroindol1ylmethyl)benzoicacid
C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)O
InChI=1SC16H15NO2c1816(19)147512(6814)111710913312415(13)17h18H911H2(H1819)
BBL003803
Synonyms: 2-(4-fluorophenyl)acetamide
Smiles: NC(=O)Cc1ccc(cc1)F
NC(=O)Cc1ccc(cc1)F
ZINC09425746
ZINC9425746
(4FLUOROPHENYL)ACETAMIDE
2(4FLUOROPHENYL)ACETAMIDE
2(4FLUOROPHENYL)ETHANAMIDE
332296
4FLUOROBENZENEACETAMIDE
4FLUOROPHENYLACETAMIDE
BENZENEACETAMIDE4FLUORO
C1=CC(=CC=C1CC(=O)N)F
InChI=1SC8H8FNOc97316(247)58(10)11h14H5H2(H21011)
BBL003804
Synonyms: 1-[(2,4,6-trimethylphenyl)sulfonyl]piperidine-3-carboxylicacid
Smiles: OC(=O)C1CCCN(C1)S(=O)(=O)c1c(C)cc(cc1C)C
OC(=O)C1CCCN(C1)S(=O)(=O)c1c(C)cc(cc1C)C
1((246TRIMETHYLPHENYL)SULFONYL)PIPERIDINE3CARBOXYLICACID
1(246TRIMETHYLBENZENESULFONYL)PIPERIDINE3CARBOXYLICACID
1(246TRIMETHYLPHENYL)SULFONYLPIPERIDINE3CARBOXYLICACID
1(MESITYLSULFONYL)PIPERIDINE3CARBOXYLICACID
385398130
3PIPERIDINECARBOXYLICACID1((246TRIMETHYLPHENYL)SULFONYL)
CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC(C2)C(=O)O)C
InChI=1SC15H21NO4Sc110711(2)14(12(3)810)21(1920)1664513(916)15(17)18h7813H469H213H3(H1718)
BBL003805
Synonyms: N-(dimethylsulfamoyl)-N-(4-fluorophenyl)glycine
Smiles: CN(S(=O)(=O)N(c1ccc(cc1)F)CC(=O)O)C
CN(S(=O)(=O)N(c1ccc(cc1)F)CC(=O)O)C
N(DIMETHYLSULFAMOYL)N(4FLUOROPHENYL)GLYCINE
ZINC21782394
1031672806
2((DIMETHYLSULFAMOYL)(4FLUOROPHENYL)AMINO)ACETIC
2(N(dimethylsulfamoyl)4fluoroanilino)aceticacid
CN(C)S(=O)(=O)N(CC(=O)O)C1=CC=C(C=C1)F
InChI=1SC10H13FN2O4Sc112(2)18(1617)13(710(14)15)9538(11)469h36H7H212H3(H1415)
BBL003806
Synonyms: N-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4-diamine
Smiles: Nc1ncnc(n1)Nc1cccc(c1)C(F)(F)F
Nc1ncnc(n1)Nc1cccc(c1)C(F)(F)F
ZINC000000089331
ZINC00089331
ZINC89331
MFCD00179648
N(3(TRIFLUOROMETHYL)PHENYL)135TRIAZINE24DIAMINE
N(3TRIFLUOROMETHYLPHENYL)(135)TRIAZINE24DIAMINE
N2(3(TRIFLUOROMETHYL)PHENYL)135TRIAZINE24DIAMINE
(4AMINO(135TRIAZIN2YL))(3(TRIFLUOROMETHYL)PHENYL)AMINE
(4AMINOSTRIAZIN2YL)(3(TRIFLUOROMETHYL)PHENYL)AMINE
135TRIAZINE24DIAMINEN2(3(TRIFLUOROMETHYL)PHENYL)
2N(3(TRIFLUOROMETHYL)PHENYL)135TRIAZINE24DIAMINE
2N(3TRIFLUOROMETHYL)PHENYL)135TRIAZINE24DIAMINE
3832697
C1=CC(=CC(=C1)NC2=NC=NC(=N2)N)C(F)(F)F
InChI=1SC10H8F3N5c1110(1213)62137(46)179165158(14)189h15H(H31415161718)
BBL003807
Synonyms: 5,6-dimethoxy-2-methyl-1,3-benzothiazole
Smiles: COc1cc2sc(nc2cc1OC)C
COc1cc2sc(nc2cc1OC)C
ZINC01786835
ZINC1786835
56DIMETHOXY2METHYL13BENZOTHIAZOLE
56DIMETHOXY2METHYLBENZO(D)THIAZOLE
56DIMETHOXY2METHYLBENZOTHIAZOLE
62306041
BENZOTHIAZOLE56DIMETHOXY2METHYL
CC1=NC2=CC(=C(C=C2S1)OC)OC
InChI=1SC10H11NO2Sc1611748(122)9(133)510(7)146h45H13H3
BBL003808
Synonyms: ethyl7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: Cc1c(cnc2n1ncn2)C(=O)OCC
Cc1c(cnc2n1ncn2)C(=O)OCC
ETHYL7METHYL(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7METHYL8HYDRO124TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
MFCD08547066
ZINC000006769846
ZINC06769846
ZINC6769846
90558966
CCOC(=O)C1=C(N2C(=NC=N2)N=C1)C
InChI=1SC9H10N4O2c13158(14)741091151213(9)6(7)2h45H3H212H3
BBL003809
Synonyms: N-[4-(propylsulfamoyl)phenyl]acetamide
Smiles: CCCNS(=O)(=O)c1ccc(cc1)NC(=O)C
CCCNS(=O)(=O)c1ccc(cc1)NC(=O)C
349398294
ACETAMIDEN(4((PROPYLAMINO)SULFONYL)PHENYL)
MFCD01213956
N(4((PROPYLAMINO)SULFONYL)PHENYL)ACETAMIDE
N(4(PROPYLSULFAMOYL)PHENYL)ACETAMIDE
ZINC000001599108
ZINC01599108
ZINC1599108
CCCNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C
InChI=1SC11H16N2O3Sc1381217(1516)116410(5711)139(2)14h4712H38H212H3(H1314)
BBL003810
Synonyms: ethyl2-(methylamino)-1,3-thiazole-4-carboxylate
Smiles: CCOC(=O)c1csc(n1)NC
CCOC(=O)c1csc(n1)NC
ETHYL2(METHYLAMINO)13THIAZOLE4CARBOXYLATE
ETHYL2(METHYLAMINO)THIAZOLE4CARBOXYLATE
ETHYL2METHYLAMINO13THIAZOLE4CARBOXYLATE
2(NMETHYLAMINO)4(ETHOXYCARBONYL)13THIAZOLE
2METHYLAMINO13THIAZOLE4CARBOXYLICACIDETHYLESTER
57250869
ZINC15020356
CCOC(=O)C1=CSC(=N1)NC
InChI=1SC7H10N2O2Sc13116(10)54127(82)95h4H3H212H3(H89)
BBL003811
Synonyms: 4-[(pyridin-3-ylcarbonyl)amino]benzoicacid
Smiles: O=C(c1cccnc1)Nc1ccc(cc1)C(=O)O
O=C(c1cccnc1)Nc1ccc(cc1)C(=O)O
PNICOTINAMIDOBENZOICACID
PNICOTINOYLAMINOBENZOICACID
ZINC517333
4((3PYRIDINYLCARBONY)AMINO)BENZOICACID
4((PYRIDIN3YLCARBONYL)AMINO)BENZOICACID
4(3PYRIDYLCARBONYLAMINO)BENZOICACID
4(PYRIDINE3CARBONYLAMINO)BENZOICACID
5768401
BENZOICACID4((3PYRIDINYLCARBONYL)AMINO)
C1=CC(=CN=C1)C(=O)NC2=CC=C(C=C2)C(=O)O
InChI=1SC13H10N2O3c1612(1021714810)1511539(4611)13(17)18h18H(H1516)(H1718)
BBL003812
Synonyms: 5-(aminomethyl)-1,3,4-thiadiazol-2-amine
Smiles: NCc1nnc(s1)N
NCc1nnc(s1)N
ZINC20206024
5(AMINOMETHYL)134THIADIAZOL2AMINE
C(C1=NN=C(S1)N)N
InChI=1SC3H6N4Sc412673(5)82h14H2(H257)
BBL003813
Synonyms: 1-(4-methoxyphenyl)-3-methylbutan-1-amine
Smiles: COc1ccc(cc1)C(CC(C)C)N
COc1ccc(cc1)C(CC(C)C)N
(1(4METHOXYPHENYL)3METHYLBUTYL)AMINE
1(4METHOXYPHENYL)3METHYLBUTAN1AMINE
645391828
CC(C)CC(C1=CC=C(C=C1)OC)N
InChI=1SC12H19NOc19(2)812(13)104611(143)7510h47912H813H213H3
BBL003814
Synonyms: methyl1-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1cc2c(n1C)cccc2
COC(=O)c1cc2c(n1C)cccc2
1HINDOLE2CARBOXYLICACID1METHYLMETHYLESTER
1METHYL1HINDOLE2CARBOXYLICACIDMETHYLESTER
1METHYL2INDOLECARBOXYLICACIDMETHYLESTER
37493348
INDOLE2CARBOXYLICACID1METHYLMETHYLESTER
INDOLE2CARBOXYLICACIDMETHYLESTER
METHYL1METHYL1HINDOLE2CARBOXYLATE
METHYL1METHYL2INDOLECARBOXYLATE
METHYL1METHYLINDOLE2CARBOXYLATE
METHYL1METHYLINDOLECARBOXYLATE
METHYLNMETHYLINDOLE2CARBOXYLATE
ZINC00348868
ZINC348868
CN1C2=CC=CC=C2C=C1C(=O)OC
InChI=1SC11H11NO2c112964358(9)710(12)11(13)142h37H12H3
BBL003815
Synonyms: 2-(3-aminophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Nc1cccc(c1)N1N=C(CC1=O)C
Nc1cccc(c1)N1N=C(CC1=O)C
ZINC00061040
ZINC61040
1(3AMINOPHENYL)3METHYL1HPYRAZOL5(4H)ONE
1(3AMINOPHENYL)3METHYL45DIHYDRO1HPYRAZOL5ONE
1(3AMINOPHENYL)3METHYL5(4H)PYRAZOLONE
1(3AMINOPHENYL)3METHYL5PYRAZOLONE
2(3AMINOPHENYL)24DIHYDRO5METHYL3HPYRAZOL3ONE
2(3AMINOPHENYL)5METHYL24DIHYDRO
2(3AMINOPHENYL)5METHYL24DIHYDRO3HPYRAZOL3ONE
2(3AMINOPHENYL)5METHYL24DIHYDROPYRAZOL3ONE
2(3AMINOPHENYL)5METHYL24DIHYDROPYRAZOL3ONEHYDROCHLORIDE
2(3AMINOPHENYL)5METHYL4HPYRAZOL3ONE
224DIHYDRO5METHYL3HPYRAZOL3ONE
3HPYRAZOL3ONE2(3AMINOPHENYL)24DIHYDRO5METHYL
90324
CC1=NN(C(=O)C1)C2=CC(=CC=C2)N
InChI=1SC10H11N3Oc17510(14)13(127)94238(11)69h246H511H21H3
BBL003816
Synonyms: 6-amino-1-propylpyrimidine-2,4(1H,3H)-dione
Smiles: CCCn1c(N)cc(=O)[nH]c1=O
CCCn1c(N)cc(=O)(nH)c1=O
1PROPYL6AMINOURACIL
53681473
MFCD00075365
ZINC000000401339
ZINC00401339
ZINC401339
6AMINO1NPROPYL24(1H3H)PYRIMIDINEDIONE
6AMINO1PROPYL13DIHYDROPYRIMIDINE24DIONE
6AMINO1PROPYL1HPYRIMIDINE24DIONE
6AMINO1PROPYL24(1H3H)PYRIMIDINDIONE
6AMINO1PROPYL3HPYRIMIDINE24DIONE
6AMINO1PROPYLPYRIMIDINE24(1H3H)DIONE
6AMINO1PROPYLPYRIMIDINE24DIONE
6AMINO1PROPYLPYRIMIDINEDIONE
6AMINO1PROPYLURACIL
CCCN1C(=CC(=O)NC1=O)N
InChI=1SC7H11N3O2c123105(8)46(11)97(10)12h4H238H21H3(H91112)
BBL003817
Synonyms: 3-(2-methoxyphenyl)propan-1-amine
Smiles: NCCCc1ccccc1OC
NCCCc1ccccc1OC
ZINC4511217
18655511
2METHOXYBENZENEPROPANAMINE
3(2METHOXYPHENYL)1PROPANAMINE
3(2METHOXYPHENYL)PROPAN1AMINE
3(2METHOXYPHENYL)PROPYLAMINE
3(METHOXYPHENYL)PROPYLAMINE
BENZENEPROPANAMINE2METHOXY
BBL003818
Synonyms: [1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
Smiles: Nc1ncnc2n1ncn2
Nc1ncnc2n1ncn2
ZINC08618478
ZINC8618478
(124)TRIAZOLO(15A)(135)TRIAZIN7AMINE
124)TRIAZOLO(15A)(135)TRIAZIN7AMINE95
124TRIAZOLO(15A)135TRIAZINE5YLAMINE
1489049
5AZAADENINE
C1=NC2=NC=NN2C(=N1)N
InChI=1SC4H4N6c53617482910(3)4h12H(H256789)
BBL003819
Synonyms: 4-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Smiles: Nc1ncnc(n1)N1CCCC1
Nc1ncnc(n1)N1CCCC1
ZINC19092383
4(1PYRROLIDINYL)135TRIAZIN2AMINE
4(1PYRROLIDINYL)135TRIAZIN2AMINE95
4(PYRROLIDIN1YL)135TRIAZIN2AMINE
4PYRROLIDIN1YL135TRIAZIN2AMINE
4PYRROLIDINYL135TRIAZINE2YLAMINE
940980961
C1CCN(C1)C2=NC(=NC=N2)N
InChI=1SC7H11N5c8695107(116)12312412h5H14H2(H2891011)
BBL003820
Synonyms: 4-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: Nc1ncnc(n1)N1CCOCC1
Nc1ncnc(n1)N1CCOCC1
STRIAZINE2AMINO4MORPHOLINO
ZINC01701973
ZINC1701973
135TRIAZIN2AMINE4(4MORPHOLINYL)
135TRIAZIN2AMINE4(4MORPHOLINYL)(9CI)
15TRIAZIN2AMINE4(4MORPHOLINYL)
2045252
2AMINO4MORPHOLINOSTRIAZINE
4(4MORPHOLINYL)135TRIAZIN2AMINE
4(MORPHOLIN4YL)135TRIAZIN2AMINE
4MORPHOLIN4YL(135)TRIAZIN2YLAMINE
4MORPHOLIN4YL135TRIAZIN2AMINE
4MORPHOLIN4YL135TRIAZINE2YLAMINE
4MORPHOLINO135TRIAZIN2AMINE
C1COCCN1C2=NC(=NC=N2)N
InChI=1SC7H11N5Oc8695107(116)1213134212h5H14H2(H2891011)
BBL003821
Synonyms: 5-chloro-1,3-benzothiazole-2-thiol
Smiles: Clc1ccc2c(c1)nc(s2)S
Clc1ccc2c(c1)nc(s2)S
SHBENZOTHIAZOLE
2(3H)BENZOTHIAZOLETHIONE5CHLORO
2(3H)BENZOTHIAZOLETHIONE5CHLORO(9CI)
ZINC1653247
2BENZOTHIAZOLETHIOL5CHLORO
2MERCAPTO5CHLOROBENZOTHIAZOLE
2METCAPTO5CHLOROBENZOTHIAZOLE
5331919
5CHLORANYL3H13BENZOTHIAZOLE2THIONE
5CHLORO13BENZOTHIAZOL2YLHYDROSULFIDE
5CHLORO13BENZOTHIAZOLE2THIOL
5CHLORO2(3H)BENZOTHIAZOLETHIONE
5CHLORO23DIHYDRO13BENZOTHIAZOLE2THIONE
5CHLORO2BENZOTHIAZOLETHIOL
5CHLORO2MERCAPTOBENZOTHIAZOLE
5CHLORO3H13BENZOTHIAZOLE2THIONE
5CHLORO3HBENZOTHIAZOLE2THIONE
5CHLORO3HYDROBENZOTHIAZOLE2THIONE
5CHLOROBENZO(D)THIAZOLE2(3H)THIONE
5CHLOROBENZO(D)THIAZOLE2THIOL
5CHLOROBENZOTHIAZOL2THIOL
5CHLOROBENZOTHIAZOLE2THIOL
BENZOTHIAZOLE5CHLORO2MERCAPTO
C1=CC2=C(C=C1Cl)NC(=S)S2
InChI=1SC7H4ClNS2c841265(34)97(10)116h13H(H910)
BBL003822
Synonyms: 1-(imidazo[1,2-a]pyridin-3-yl)methanamine
Smiles: NCc1cnc2n1cccc2
NCc1cnc2n1cccc2
ZINC19093493
(IMIDAZO(12A)PYRIDIN3YLMETHYL)AMINE
(IMIDAZO(12A)PYRIDIN3YLMETHYL)AMINEDIHYDROCHLORIDE
1(IMIDAZO(12A)PYRIDIN3YL)METHANAMINE
160771891
CIMIDAZO(12A)PYRIDIN3YLMETHYLAMINE
IMIDAZO(12A)PYRIDIN3YLMETHANAMINE
IMIDAZO(12A)PYRIDINE3METHANAMINE
C1=CC2=NC=C(N2C=C1)CN
InChI=1SC8H9N3c9576108312411(7)8h146H59H2
BBL003823
Synonyms: ethyl3-(4-fluorophenyl)-3-oxopropanoate
Smiles: CCOC(=O)CC(=O)c1ccc(cc1)F
CCOC(=O)CC(=O)c1ccc(cc1)F
ETHYL(4FLUOROBENZOYL)ACETATE
ETHYL(PFLUOROBENZOYL)ACETATE
ETHYL3(4FLUOROPHENYL)3OXOPROPANOATE
ETHYL3(4FLUOROPHENYL)3OXOPROPIONATE
ETHYL3OXO3(4FLUOROPHENYL)PROPIONATE
ETHYL4FLUOROBENZOYLACETATE
ETHYL4FLUOROPHENYL3OXOPROPANOATE
ETHYLBETA(PFLUOROPHENYL)BETAOXOPROPIONATE
ETHYLPFLUOROBENZOYLACETATE
(4FLUOROBENZOYL)ACETICACIDETHYLESTER
(PFLUOROBENZOYL)ACETICACIDETHYLESTER
1999004
3(4FLUOROPHENYL)3OXOPROPANOICACIDETHYLESTER
3(4FLUOROPHENYL)3OXOPROPIONICACIDETHYLESTER
3(4FLUOROPHENYL)3OXOPROPIONICETHYLESTER
4FLUORBENZOYLACETICACIDETHYLESTER
4FLUOROBENZOYLACETICACIDETHYLESTER
4FLUOROBETAOXOBENZENEPROPANOICACIDETHYLESTER
BENZENEPROPANOICACID4FLUOROAOXOETHYLESTER
BENZENEPROPANOICACID4FLUOROBETAOXOETHYLESTER
ZINC02506659
ZINC2506659
CCOC(=O)CC(=O)C1=CC=C(C=C1)F
InChI=1SC11H11FO3c121511(14)710(13)8359(12)648h36H27H21H3
BBL003824
Synonyms: 1-[2-(2-methyl-1H-imidazol-1-yl)phenyl]methanamine
Smiles: NCc1ccccc1n1ccnc1C
NCc1ccccc1n1ccnc1C
ZINC4384391
(2(2METHYL1HIMIDAZOL1YL)PHENYL)METHANAMINE
(2(2METHYLIMIDAZOL1YL)PHENYL)METHANAMINE
(2(2METHYLIMIDAZOLYL)PHENYL)METHYLAMINE
1(2(2METHYL1HIMIDAZOL1YL)PHENYL)METHANAMINE
2(2METHYL1HIMIDAZOL1YL)BENZYLAMINE
2(2METHYL1HIMIDAZOL1YL)BENZYLAMINE97
2(2METHYLIMIDAZOL1YL)BENZYLAMINE
876717292
BENZENEMETHANAMINE2(2METHYL1HIMIDAZOL1YL)
CC1=NC=CN1C2=CC=CC=C2CN
InChI=1SC11H13N3c19136714(9)11532410(11)812h27H812H21H3
BBL003825
Synonyms: N-phenyl-1,3-benzothiazol-2-amine
Smiles: c1ccc(cc1)Nc1nc2c(s1)cccc2
c1ccc(cc1)Nc1nc2c(s1)cccc2
MFCD00453249
NPHENYL13BENZOTHIAZOL2AMINE
NPHENYL2BENZOTHIAZOLAMINE
NPHENYL2BENZOTHIAZOLYLAMINE
ZINC000037858826
ZINC37858826
13BENZOTHIAZOL2YL(PHENYL)AMINE
1843216
2ANILINOBENZOTHIAZOLE
2BENZOTHIAZOLAMINENPHENYL
BENZOTHIAZOL2AMINENPHENYL
BENZOTHIAZOL2YLPHENYLAMINE
BENZOTHIAZOLE2ANILINO
BENZOTHIAZOLYLPHENYLAMINE
C1=CC=C(C=C1)NC2=NC3=CC=CC=C3S2
InChI=1SC13H10N2Sc12610(731)14131511845912(11)1613h19H(H1415)
BBL003826
Synonyms: 6-amino-1-ethylpyrimidine-2,4(1H,3H)-dione
Smiles: CCn1c(N)cc(=O)[nH]c1=O
CCn1c(N)cc(=O)(nH)c1=O
MFCD00091925
ZINC000000399854
ZINC00399854
ZINC399854
24(1H3H)PYRIMIDINEDIONE6AMINO1ETHYL
41862093
6AMINO1ETHYL13DIHYDROPYRIMIDINE24DIONE
6AMINO1ETHYL1HPYRIMIDINE24DIONE
6AMINO1ETHYL24(1H3H)PYRIMIDINEDIONE
6AMINO1ETHYLPYRIMIDINE24(1H3H)DIONE
6AMINO1ETHYLPYRIMIDINE24DIONE
CCN1C(=CC(=O)NC1=O)N
InChI=1SC6H9N3O2c1294(7)35(10)86(9)11h3H27H21H3(H81011)
BBL003827
Synonyms: 3-methyl-1-phenylbutan-1-amine
Smiles: NC(c1ccccc1)CC(C)C
NC(c1ccccc1)CC(C)C
3METHYL1PHENYLBUTAN1AMINE
3METHYL1PHENYLBUTYLAMINE
42290971
BENZENEMETHANAMINEA(2METHYLPROPYL)
CC(C)CC(C1=CC=CC=C1)N
InChI=1SC11H17Nc19(2)811(12)106435710h37911H812H212H3
BBL003828
Synonyms: 1-(2-methylphenoxy)propan-2-amine
Smiles: CC(COc1ccccc1C)N
CC(COc1ccccc1C)N
1(2AMINOPROPOXY)2METHYLBENZENE
1(2METHYLPHENOXY)2PROPANAMINE
1(2METHYLPHENOXY)2PROPANAMINE95
1(2METHYLPHENOXY)PROPAN2AMINE
1(OTOLYLOXY)PROPAN2AMINE
59722224
CC1=CC=CC=C1OCC(C)N
InChI=1SC10H15NOc18534610(8)1279(2)11h369H711H212H3
BBL003829
Synonyms: 2,6-diaminopyrimidin-4(3H)-one
Smiles: Nc1nc(N)[nH]c(=O)c1
Nc1nc(N)(nH)c(=O)c1
PYRIMIDIN4OL26DIAMINO
ZINC000008602956
ZINC08602956
ZINC8602956
24DIAMINO6(1H)PYRIMIDONE
24DIAMINO6HYDROXYPYRIMIDIINE
24DIAMINO6HYDROXYPYRIMIDINE
24DIAMINO6HYDROXYPYRIMIDINE98
24DIAMINO6PYRIMIDINOL
24DIAMINO6PYRIMIDINONE
24DIAMINOHYPOXANTHINE
24DIAMINOPYRIMIDIN6OL
26BIS(AZANYL)1HPYRIMIDIN4ONE
26DIAMINO14DIHYDROPYRIMIDIN4ONE
26DIAMINO1HPYRIMIDIN4ONE
26DIAMINO34DIHYDROPYRIMIDIN4ONE
26DIAMINO3HPYRIMIDIN4ONE
26DIAMINO4(1H)PYRIMIDINONE
26DIAMINO4(3H)PYRIMIDINONE
26DIAMINO4HYDROXYPYRIMIDINE
26DIAMINO4PYRIMIDINOL
26DIAMINO4PYRIMIDINONE
26DIAMINOHYDROPYRIMIDIN4ONE
26DIAMINOPYRIMIDIN4(1H)ONE
26DIAMINOPYRIMIDIN4(3H)ONE
26DIAMINOPYRIMIDIN4OL
26DIAMINOPYRIMIDIN4ONE
2AMINOISOCYTOSINE
24DIAMINO6(1H)PYRIMIDI
24DIAMINO6(1H)PYRIMIDINONE
4(1H)PYRIMIDINONE26DIAMINO
4(1H)PYRIMIDINONE6DIAMINO
4(3H)PYRIMIDINONE26DIAMINO
4PYRIMIDINOL26DIAMINO(9CI)
56064
6AMINOISOCYTOSINE
6HYDROXY24PYRIMIDINEDIAMINE
DAHP24DIAMINO6HYDROXYPYRIMIDINE
MFCD00043013
C1=C(NC(=NC1=O)N)N
InChI=1SC4H6N4Oc5213(9)84(6)72h1H(H556789)
BBL003830
Synonyms: 1-(3-aminopropyl)pyrrolidine-2,5-dione
Smiles: NCCCN1C(=O)CCC1=O
NCCCN1C(=O)CCC1=O
ZINC3092771
1(3AMINOPROPYL)25PYRROLIDINEDIONE
1(3AMINOPROPYL)PYRROLIDINE25DIONE
C1CC(=O)N(C1=O)CCCN
InChI=1SC7H12N2O2c841596(10)237(9)11h158H2
BBL003831
Synonyms: 1-(2-aminoethyl)pyrrolidine-2,5-dione
Smiles: NCCN1C(=O)CCC1=O
NCCN1C(=O)CCC1=O
ZINC22175645
1(2AMINOETHYL)25PYRROLIDINEDIONE
1(2AMINOETHYL)PYRROLIDINE25DIONE
25660199
25PYRROLIDINEDIONE1(2AMINOETHYL)
N(2AMINOETHYL)SUCCINIMIDE
BBL003832
Synonyms: 2-methylnaphtho[1,2-d][1,3]thiazole
Smiles: Cc1nc2c(s1)ccc1c2cccc1
Cc1nc2c(s1)ccc1c2cccc1
2682453
2METHYINAPHTHO(12D)THIAZOLE
2METHYLBENZO(E)(13)BENZOTHIAZOLE
2METHYLBENZO(E)BENZOTHIAZOLE
2METHYLBETANAPHTHOTHIAZOLE
2METHYLBNAPHTHOTHIAZOLE
2METHYLBNAPHTHYLTHIAZOLE
2METHYLNAPHTHO(12D)(13)THIAZOLE
2METHYLNAPHTHO(12D)THIAZOLE
2METHYLNAPHTOTHIAZOLE
MFCD00004951
NAPHTH(12D)THIAZOLE2METHYL
NAPHTH(12METHYL
NAPHTHO(12D)THIAZOLE2METHYL
NAPHTHO(12METHYL
ZINC000000134498
ZINC00134498
ZINC134498
CC1=NC2=C(S1)C=CC3=CC=CC=C32
InChI=1SC12H9NSc1813121053249(10)6711(12)148h27H1H3
BBL003833
Synonyms: 4-[(1-{[5-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl}amino)-2-chlorophenyl]amino}-4,4-dimethyl-1,3-dioxopentan-2-yl)oxy]benzoicacid
Smiles: CCC(c1cc(ccc1OCCCC(=O)Nc1ccc(c(c1)NC(=O)C(C(=O)C(C)(C)C)Oc1ccc(cc1)C(=O)O)Cl)C(CC)(C)C)(C)C
CCC(c1cc(ccc1OCCCC(=O)Nc1ccc(c(c1)NC(=O)C(C(=O)C(C)(C)C)Oc1ccc(cc1)C(=O)O)Cl)C(CC)(C)C)(C)C
2((4CARBOXYPHENOXY)44DIMETHYL3OXOPENTANOICACID(2CHLOR5(4(24DITERTPENTYLPHENOXY)BUTYRAMIDO))ANILIDE
4((1((5((4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANOYL)AMINO)2CHLOROPHENYL)AMINO)44DIMETHYL13DIOXOPENTAN2YL)OXY)BENZOICACID
4(1(((5((4(24BIS(11DIMETHYLPROPYL)PHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)BENZOICACID
4(1(((5((4(24BIS(TERTPENTYL)PHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)BENZOICACID
4(1((5(4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANAMIDO)2CHLOROPHENYL)CARBAMOYL)33DIMETHYL2OXOBUTOXY)BENZOICACID
4(1(5(4(24BIS(2METHYLBUTAN2YL)PHENOXY)BUTANOYLAMINO)2CHLOROANILINO)44DIMETHYL13DIOXOPENTAN2YL)OXYBENZOICACID
4(1(N(5(4(24BIS(11DIMETHYLPROPYL)PHENOXY)BUTANOYLAMINO)2CHLOROPHENYL)CARBAMOYL)33DIMETHYL2OXOBUTOXY)BENZOICACID
4(A(2CHLORO5(4(24DITERTPENTYLPHENOXY)BUTYRAMIDO)PHENYLCARBAMOYL)APIVALOYLMETHOXY)BENZOICACID
53918539
BENZOICACID4(1(((5((4(24BIS(11DIMETHYLPROPYL)PHENOXY)1OXOBUTYL)AMINO)2CHLOROPHENYL)AMINO)CARBONYL)33DIMETHYL2OXOBUTOXY)
CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)C(=O)O)C(C)(C)CC
InChI=1SC40H51ClN2O7c11039(67)26162132(29(2326)40(89)112)4922121333(44)4227172030(41)31(2427)4336(46)34(35(45)38(34)5)5028181425(151928)37(47)48h1421232434H101322H219H3(H4244)(H4346)(H4748)
BBL003834
Synonyms: N-(2,5-dimethoxyphenyl)-1,3,5-triazine-2,4-diamine
Smiles: COc1ccc(cc1Nc1ncnc(n1)N)OC
COc1ccc(cc1Nc1ncnc(n1)N)OC
(4AMINO(135TRIAZIN2YL))(25DIMETHOXYPHENYL)AMINE
2N(25DIMETHOXYPHENYL)135TRIAZINE24DIAMINE
685113637
MFCD04111497
N(25DIMETHOXYPHENYL)(135)TRIAZINE24DIAMINE
N(25DIMETHOXYPHENYL)135TRIAZINE24DIAMINE
ZINC000000089479
ZINC00089479
ZINC89479
COC1=CC(=C(C=C1)OC)NC2=NC=NC(=N2)N
InChI=1SC11H13N5O2c1177349(182)8(57)15111461310(12)1611h36H12H3(H31213141516)
BBL003835
Synonyms: 3-[(2-methylbenzyl)sulfanyl]-1H-1,2,4-triazol-5-amine
Smiles: Cc1ccccc1CSc1n[nH]c(n1)N
Cc1ccccc1CSc1n(nH)c(n1)N
ZINC06451566
ZINC6451566
3((2METHYLBENZYL)SULFANYL)1H124TRIAZOL5AMINE
3((2METHYLPHENYL)METHYLSULFANYL)1H124TRIAZOL5AMINE
3((2METHYLPHENYL)METHYLTHIO)1H124TRIAZOLE5YLAMINE
5((2METHYLBENZYL)SULFANYL)1H124TRIAZOL3YLAMINE
5(2METHYLBENZYLSULFANYL)2H(124)TRIAZOL3YLAMINE
849524409
CC1=CC=CC=C1CSC2=NNC(=N2)N
InChI=1SC10H12N4Sc1742358(7)61510129(11)131410h25H6H21H3(H311121314)
BBL003836
Synonyms: 1-[4,6-dimethyl-2-(morpholin-4-yl)pyrimidin-5-yl]ethanone
Smiles: CC(=O)c1c(C)nc(nc1C)N1CCOCC1
CC(=O)c1c(C)nc(nc1C)N1CCOCC1
ETHANONE1(46DIMETHYL2(4MORPHOLINYL)5PYRIMIDINYL)
1(46DIMETHYL2(MORPHOLIN4YL)PYRIMIDIN5YL)ETHANONE
5ACETYL46DIMETHYL2MORPHOLIN4YLPYRIMIDINE
924874486
ZINC13640214
1(46dimethyl2morpholin4ylpyrimidin5yl)ethanone
CC1=C(C(=NC(=N1)N2CCOCC2)C)C(=O)C
InChI=1SC12H17N3O2c1811(10(3)16)9(2)1412(138)1546177515h47H213H3
BBL003837
Synonyms: 6-amino-1-[3-(morpholin-4-yl)propyl]pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1cc(N)n(c(=O)[nH]1)CCCN1CCOCC1
O=c1cc(N)n(c(=O)(nH)1)CCCN1CCOCC1
ZINC13639028
6AMINO1(3(MORPHOLIN4YL)PROPYL)PYRIMIDINE24(1H3H)DIONE
6AMINO1(3MORPHOLIN4YLPROPYL)13DIHYDROPYRIMIDINE24DIONE
6AMINO1(3MORPHOLIN4YLPROPYL)1HPYRIMIDINE24DIONE
6AMINO1(3MORPHOLIN4YLPROPYL)PYRIMIDINE24(1H3H)DIONE
6AMINO4HYDROXY1(3(MORPHOLIN4YL)PROPYL)PYRIMIDIN2(1H)ONE
924846855
MFCD09439082
ZINC000013639028
6amino1(3morpholin4ylpropyl)pyrimidine24dione
C1COCCN1CCCN2C(=CC(=O)NC2=O)N
InChI=1SC11H18N4O3c129810(16)1311(17)15(9)3121446187514h8H1712H2(H131617)
BBL003838
Synonyms: N-(tetrahydrofuran-2-ylmethyl)-1H-benzimidazol-2-amine
Smiles: C1COC(C1)CNc1nc2c([nH]1)cccc2
C1COC(C1)CNc1nc2c((nH)1)cccc2
924859574
BENZIMIDAZOL2YL(OXOLAN2YLMETHYL)AMINE
N(OXOLAN2YLMETHYL)1H13BENZODIAZOL2AMINE
N(TETRAHYDROFURAN2YLMETHYL)1HBENZIMIDAZOL2AMINE
N(oxolan2ylmethyl)1Hbenzimidazol2amine
C1CC(OC1)CNC2=NC3=CC=CC=C3N2
InChI=1SC12H15N3Oc1261110(51)1412(1511)1389437169h12569H3478H2(H2131415)
BBL003839
Synonyms: [1-(4-fluorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]aceticacid
Smiles: OC(=O)CC1C(=NN(C1=O)c1ccc(cc1)F)C
OC(=O)CC1C(=NN(C1=O)c1ccc(cc1)F)C
ZINC000014951301
ZINC000100126725
MFCD10476947
(1(4FLUOROPHENYL)3METHYL5OXO45DIHYDRO1HPYRAZOL4YL)ACETICACID
1011416504
2(1(4fluorophenyl)3methyl5oxo4Hpyrazol4yl)aceticacid
CC1=NN(C(=O)C1CC(=O)O)C2=CC=C(C=C2)F
InChI=1SC12H11FN2O3c1710(611(16)17)12(18)15(147)9428(13)359h2510H6H21H3(H1617)
BBL003840
Synonyms: methyl(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)acetate
Smiles: COC(=O)CC1C(=NN(C1=O)c1ccccc1)C
COC(=O)CC1C(=NN(C1=O)c1ccccc1)C
(3METHYL5OXO1PHENYL45DIHYDRO1HPYRAZOL4YL)ACETICACIDMETHYLESTER
1011416468
METHYL(3METHYL5OXO1PHENYL45DIHYDRO1HPYRAZOL4YL)ACETATE
METHYL2(3METHYL5OXO1PHENYL2PYRAZOLIN4YL)ACETATE
MFCD10476944
ZINC000020153762
ZINC000100126712
methyl2(3methyl5oxo1phenyl4Hpyrazol4yl)acetate
CC1=NN(C(=O)C1CC(=O)OC)C2=CC=CC=C2
InChI=1SC13H14N2O3c1911(812(16)182)13(17)15(149)106435710h3711H8H212H3
BBL003841
Synonyms: 5-(4-fluorophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1NN=C(C1)c1ccc(cc1)F
O=C1NN=C(C1)c1ccc(cc1)F
ZINC100088307
24DIHYDRO5(4FLUOROPHENYL)3HPYRAZOL3ONE
264208459
3(4FLUOROPHENYL)14DIHYDROPYRAZOL5ONE
3(4FLUOROPHENYL)1HPYRAZOL5(4H)ONE
3(4FLUOROPHENYL)45DIHYDRO1HPYRAZOL5ONE
5(4FLUOROPHENYL)24DIHYDRO3HPYRAZOL3ONE
5(4FLUOROPHENYL)24DIHYDROPYRAZOL3ONE
C1C(=NNC1=O)C2=CC=C(C=C2)F
InChI=1SC9H7FN2Oc107316(247)859(13)12118h14H5H2(H1213)
BBL003842
Synonyms: 4-(3-nitrophenyl)pyrimidin-2-amine
Smiles: Nc1nccc(n1)c1cccc(c1)[N+](=O)[O-]
Nc1nccc(n1)c1cccc(c1)(N+)(=O)(O)
ZINC02567199
ZINC2567199
240136690
2AMINO4(3NITROPHENYL)PYRIMIDINE
4(3NITROPHENYL)PYRIMIDIN2AMINE
4(3NITROPHENYL)PYRIMIDIN2YLAMINE
4(3NITROPHENYL)PYRIMIDINE2YLAMINE
C1=CC(=CC(=C1)(N+)(=O)(O))C2=NC(=NC=C2)N
InChI=1SC10H8N4O2c111012549(1310)72138(67)14(15)16h16H(H2111213)
BBL003843
Synonyms: 2-amino-6-(4-fluorophenyl)pyrimidin-4(3H)-one
Smiles: Fc1ccc(cc1)c1cc(=O)[nH]c(n1)N
Fc1ccc(cc1)c1cc(=O)(nH)c(n1)N
MFCD00982517
ZINC000001512218
ZINC01512218
ZINC1512218
2AMINO6(4FLUOROPHENYL)1HPYRIMIDIN4ONE
2AMINO6(4FLUOROPHENYL)3HPYRIMIDIN4ONE
2AMINO6(4FLUOROPHENYL)3HYDROPYRIMIDIN4ONE
2AMINO6(4FLUOROPHENYL)4(3H)PYRIMIDINONE
2AMINO6(4FLUOROPHENYL)PYRIMIDIN4(3H)ONE
2AMINO6(4FLUOROPHENYL)PYRIMIDIN4OL
4(1H)PYRIMIDINONE2AMINO6(4FLUOROPHENYL)
4HYDROXY6(4FLUOROPHENYL)PYRIMIDIN2AMINE
98305749
C1=CC(=CC=C1C2=CC(=O)N=C(N2)N)F
InChI=1SC10H8FN3Oc117316(247)859(15)1410(12)138h15H(H312131415)
BBL003844
Synonyms: ethyl2-methyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1C(=O)CCC2
CCOC(=O)c1c(C)oc2c1C(=O)CCC2
ethyl2methyl4oxo4567tetrahydro1benzofuran3carboxylate
ETHYL2METHYL4OXO567TRIHYDROBENZO(12B)FURAN3CARBOXYLATE
1049031608
MFCD12405234
ZINC000022126453
ZINC22126453
ethyl2methyl4oxo67dihydro5H1benzofuran3carboxylate
CCOC(=O)C1=C(OC2=C1C(=O)CCC2)C
InChI=1SC12H14O4c131512(14)107(2)1696458(13)11(9)10h36H212H3
BBL003845
Synonyms: 1-(3,4,5-trimethoxyphenyl)methanamine
Smiles: COc1cc(CN)cc(c1OC)OC
COc1cc(CN)cc(c1OC)OC
ZINC389604
(345TRIMETHOXYPHENYL)METHANAMINE
(345TRIMETHOXYPHENYL)METHYLAMINE
1(345TRIMETHOXYPHENYL)METHANAMINE
18638998
345TRIMETHOXYBENZYLAMINE
BENZENEMETHANAMINE345TRIMETHOXY
COC1=CC(=CC(=C1OC)OC)CN
InChI=1SC10H15NO3c112847(611)59(132)10(8)143h45H611H213H3
BBL003846
Synonyms: 4-nitrobenzamide
Smiles: NC(=O)c1ccc(cc1)[N+](=O)[O-]
NC(=O)c1ccc(cc1)(N+)(=O)(O)
PNITROBENZAMIDE
PNITROBENZAMIDE98
ZINC00163490
ZINC163490
4CARBAMOYLNITROBENZENE
ZINC000000163490
4NITROBENZAMIDE
619807
BENZAMIDE4NITRO
BENZAMIDEPNITRO
MFCD00007994
C1=CC(=CC=C1C(=O)N)(N+)(=O)(O)
InChI=1SC7H6N2O3c87(10)5136(425)9(11)12h14H(H2810)
BBL003847
Synonyms: 3-(3,4-dichlorophenyl)-1,1-dimethylurea
Smiles: O=C(N(C)C)Nc1ccc(c(c1)Cl)Cl
O=C(N(C)C)Nc1ccc(c(c1)Cl)Cl
PREVENTOLA6
TELVARDIURONWEEDKILLER
UREA3(34DICHLOROPHENYL)11DIMETHYL
UREA4DICHLOROPHENYL)11DIMETHYL
UREA4DICHLOROPHENYL)NNDIMETHYL
UREAN(34DICHLOROPHENYL)NNDIMETHYL
ZINC00057287
ZINC57287
1(34DICHLOROPHENYL)33DIMETHYLUREE
1(34DICHLOROPHENYL)33DIMETHYLUREE(FRENCH)
11DIMETHYL3(34DICHLOROPHENYL)UREA
14DICHLOROPHENYL)UREA
3(31DIMETHYLHARNSTOFF
3(31DIMETHYLUREA
3(31DIMETHYLUREUM
3(34DICHLOORFENYL)11DIMETHYLUREUM
3(34DICHLOROPHENOL)11DIMETHYLUREA
3(34DICHLOROPHENYL)11DIMETHYLUREA
3(34DICHLORPHENYL)11DIMETHYLHARNSTOFF
330541
DICHLORFENIDIM
DIURON
DIURON(ANSIBSIISO)
DIURON4L
DIURON900
DIURONNORTOX
DIURONSOLUTION
DIURONSOLUTION100NGMULINACETONITRILE
DREXELDIURON4L
FARMCODIURON
KARMEXDIURONHERBICIDE
N(34DICHLOROPHENYL)(DIMETHYLAMINO)CARBOXAMIDE
N(34DICHLOROPHENYL)NNDIMETHYLUREA
N(3NDIMETHYLUREA
NNDIMETHYLN(34DICHLOROPHENYL)UREA
1(33DIMETHYLUREA
1(34DICHLOROPHENYL)33DIMETHYLUREA
CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl
InChI=1SC9H10Cl2N2Oc113(2)9(14)126347(10)8(11)56h35H12H3(H1214)
BBL003848
Synonyms: N,4-dimethylbenzenesulfonamide
Smiles: CNS(=O)(=O)c1ccc(cc1)C
CNS(=O)(=O)c1ccc(cc1)C
(PTOLYLSULFONYL)METHYLAMINE
4NDIMETHYLBENZENESULPHONAMIDE
70553
BENZENESULFONAMIDE4DIMETHYL
BENZENESULFONAMIDEN4DIMETHYL
METHYL((4METHYLPHENYL)SULFONYL)AMINE
N4DIMETHYLBENZENE1SULFONAMIDE
N4DIMETHYLBENZENESULFONAMIDE
NMETHYL4METHYLBENZENESULFONAMIDE
NMETHYLPARATOLUENESULFONAMIDE
NMETHYLPTOLUENESULFONAMIDE
NMETHYLPTOLUENESULPHONAMIDE
NMETHYLPTOLUOLSULFONAMIDE
NMETHYLTOLUENE4SULPHONAMIDE
PTOLUENENMETHYLSULFONAMIDE
PTOLUENESULFONAMIDENMETHYL
PTOLUENESULFONAMIDENMETHYL(8CI)
ZINC00300857
ZINC300857
CC1=CC=C(C=C1)S(=O)(=O)NC
InChI=1SC8H11NO2Sc17358(647)12(1011)92h369H12H3
BBL003849
Synonyms: 1,1'-disulfanediylbis(2-nitrobenzene)
Smiles: [O-][N+](=O)c1ccccc1SSc1ccccc1[N+](=O)[O-]
(O)(N+)(=O)c1ccccc1SSc1ccccc1(N+)(=O)(O)
1155006
11DISULFANEDIYLBIS(2NITROBENZENE)
1NITRO2((2NITROPHENYL)DISULFANYL)BENZENE
22DINITRODIPHENYLDISULFIDE
2NITROPHENYLDISULFIDE
BIS(2NITROPHENYL)DISULFIDE
BIS(2NITROPHENYL)DISULPHIDE
BIS(2NITROPHENYL)PERSULFIDE
BIS(ONITROPHENYL)DISULFIDE
DI(2NITROPHENYL)DISULPHIDE
DI2NITROPHENYLDISULFIDE
DISULFIDEBIS(2NITROPHENYL)
DISULFIDEBIS(ONITROPHENYL)
DISULFIDEBIS(ONITROPHENYL)(8CI)
HYDROXY(2((2(HYDROXY(OXIDO)AMINO)PHENYL)DITHIO)PHENYL)AZANEOXIDE
MFCD00007130
ONITROPHENYLDISULFIDE
OODINITRODIPHENYLDISULFIDE
ZINC000001555351
ZINC01555351
ZINC1555351
C1=CC=C(C(=C1)(N+)(=O)(O))SSC2=CC=CC=C2(N+)(=O)(O)
InChI=1SC12H8N2O4S2c1513(16)9513711(9)192012842610(12)14(17)18h18H
BBL003850
Synonyms: 3-{2-[(E)-2-(phenylamino)ethenyl]-4,5-dihydro-1,3-thiazol-3-ium-3-yl}propane-1-sulfonate
Smiles: [O-]S(=O)(=O)CCC[N+]1=C(SCC1)/C=C/Nc1ccccc1
(O)S(=O)(=O)CCC(N+)1=C(SCC1)C=CNc1ccccc1
2(2(PHENYLAMINO)ETHENYL)3(3SULFONATOPROPYL)45DIHYDRO13THIAZOL3IUM
2(2ANILINOVINYL)3(3SULFOPROPYL)2THIAZOLINIUMINNERSALT
2(2ANILINOVINYL)3(3SULFOPROPYL)2THIAZOLINIUMINNERSALT98
2(2ANILINOVINYL)45DIHYDRO3(3SULPHONATOPROPYL)THIAZOLIUM
232THIAZOLINIUMINNERSALT
3(2((1E)2(PHENYLAMINO)VINYL)13THIAZOLIN3YL)PROPANESULFONICACID
3(2((E)2(PHENYLAMINO)ETHENYL)45DIHYDRO13THIAZOL3IUM3YL)PROPANE1SULFONATE
3(2((E)2ANILINOETHENYL)45DIHYDRO13THIAZOL3IUM3YL)PROPANE1SULFONATE
3(2((E)2ANILINOVINYL)45DIHYDRO13THIAZOL3IUM3YL)PROPANE1SULFONATE
3(2(2(PHENYLIMINIO)ETHYLIDENE)13THIAZOLIDIN3YL)PROPANE1SULFONATE
3(2(2(PHENYLIMINIUMYL)ETHYLIDENE)13THIAZOLIDIN3YL)PROPANE1SULFONATE
3(2(2ANILINOETHENYL)45DIHYDRO13THIAZOL3IUM3YL)PROPANE1SULFONATE
3(2(2ANILINOVINYL)45DIHYDRO13THIAZOL3IUM3YL)PROPANE1SULFONATE
3(2(2ANILINOVINYL)45DIHYDRO13THIAZOL3IUM3YL)PROPANE1SULPHONATE
3(2(2PHENYLIMINOETHYLIDENE)13THIAZOLIDIN3YL)PROPANE1SULFONICACID
42825730
THIAZOLIUM45DIHYDRO2(2(PHENYLAMINO)ETHENYL)3(3SULFOPROPYL)HYDROXIDEINNERSALT
THIAZOLIUM45DIHYDRO2(2(PHENYLAMINO)ETHENYL)3(3SULFOPROPYL)INNERSALT
ZINC02512300
C1CSC(=(N+)1CCCS(=O)(=O)(O))C=CNC2=CC=CC=C2
InChI=1SC14H18N2O3S2c1721(1819)12491610112014(16)7815135213613h1358H4912H2(H171819)
BBL003851
Synonyms: 3-(2-methyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
Smiles: Cc1sc2c([n+]1CCCS(=O)(=O)[O-])cccc2
Cc1sc2c((n+)1CCCS(=O)(=O)(O))cccc2
ZINC01877492
2METHYL3(3SULFONATOPROPYL)13BENZOTHIAZOL3IUM
2METHYL3(3SULPHONATOPROPYL)BENZOTHIAZOLIUM
2METHYL3(GAMMASULFOPROPYL)BENZOTHIAZOLIUMHYDROXIDEINNERSALT
2METHYL3SULFOPROPYLBENZOTHIAZOLIUMINNERSALT
3(2METHYL13BENZOTHIAZOL3IUM3YL)PROPANE1SULFONATE
3(2METHYL13BENZOTHIAZOL3IUM3YL)PROPANE1SULPHONATE
3(2METHYLBENZOTHIAZOL3YL)PROPANESULFONICACID
56405379
BENZOTHIAZOLIUM2METHYL3(3SULFOPROPYL)HYDROXIDEINNERSALT
BENZOTHIAZOLIUM2METHYL3(3SULFOPROPYL)INNERSALT
CC1=(N+)(C2=CC=CC=C2S1)CCCS(=O)(=O)(O)
InChI=1SC11H13NO3S2c1912(74817(1314)15)10523611(10)169h2356H478H21H3
BBL003852
Synonyms: 11-(2-chlorophenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CCCC2=C1C(Nc1c(N2)cc(cc1)C(=O)c1ccccc1)c1ccccc1Cl
O=C1CCCC2=C1C(Nc1c(N2)cc(cc1)C(=O)c1ccccc1)c1ccccc1Cl
11(2chlorophenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
297160464
ZINC000000864943
ZINC000008397122
MFCD02109803
2benzoyl6(2chlorophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5Cl)C(=O)C1
InChI=1SC26H21ClN2O2c27191054918(19)252421(1161223(24)30)28221517(131420(22)2925)26(31)167213816h157101315252829H61112H2
BBL003853
Synonyms: 11-(2,4-dimethoxyphenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1cc(OC)ccc1C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
COc1cc(OC)ccc1C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
11(24dimethoxyphenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312626496
2benzoyl6(24dimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=C(C=C1)C2C3=C(CCCC3=O)NC4=C(N2)C=CC(=C4)C(=O)C5=CC=CC=C5)OC
InChI=1SC28H26N2O4c13319121320(25(1619)342)272622(961024(26)31)29231518(111421(23)3027)28(32)177435817h35781116272930H6910H212H3
BBL003854
Synonyms: 11-(5-methylfuran-2-yl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Cc1ccc(o1)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
Cc1ccc(o1)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
11(5methylfuran2yl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312626350
2benzoyl6(5methylfuran2yl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CC1=CC=C(O1)C2C3=C(CCCC3=O)NC4=C(N2)C=CC(=C4)C(=O)C5=CC=CC=C5
InChI=1SC25H22N2O3c115101322(3015)242319(85921(23)28)26201417(111218(20)2724)25(29)166324716h24671014242627H589H21H3
BBL003855
Synonyms: 11-(3-bromophenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Brc1cccc(c1)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
Brc1cccc(c1)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
11(3bromophenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312626485
2benzoyl6(3bromophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC(=CC=C5)Br)C(=O)C1
InChI=1SC26H21BrN2O2c271994817(1419)252421(1051123(24)30)28221518(121320(22)2925)26(31)166213716h14691215252829H51011H2
BBL003856
Synonyms: 11-(4-fluorophenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Fc1ccc(cc1)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
Fc1ccc(cc1)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
11(4fluorophenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4FLUOROPHENYL)7(PHENYLCARBONYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
297160226
2benzoyl6(4fluorophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)F)C(=O)C1
InChI=1SC26H21FN2O2c271912916(101319)252421(74823(24)30)28221518(111420(22)2925)26(31)175213617h1356915252829H478H2
BBL003857
Synonyms: 3,3-dimethyl-7-(phenylcarbonyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cc(cc1)C(=O)c1ccccc1)c1cccs1
O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cc(cc1)C(=O)c1ccccc1)c1cccs1
33dimethyl7(phenylcarbonyl)11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
332849522
33DIMETHYL7(PHENYLCARBONYL)11(2THIENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
2benzoyl99dimethyl6thiophen2yl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC=CS5)C(=O)C1)C
InChI=1SC26H24N2O2Sc126(2)142023(21(29)1526)24(2296123122)2818111017(1319(18)2720)25(30)167435816h313242728H1415H212H3
BBL003858
Synonyms: N'-(propan-2-ylidene)acetohydrazide
Smiles: CC(=NNC(=O)C)C
CC(=NNC(=O)C)C
2PROPANONEACETYLHYDRAZONE
3742630
ACETICACID2(1METHYLETHYLIDENE)HYDRAZIDE
ACETICACIDISOPROPYLIDENEHYDRAZIDE
ACETONEACETYLHYDRAZONE
N(1METHYLETHYLIDENE)ACETOHYDRAZIDE
N(2METHYL1AZAPROP1ENYL)ACETAMIDE
N(ISOPROPYLIDENEAMINO)ACETAMIDE
N(PROPAN2YLIDENE)ACETOHYDRAZIDE
N(PROPAN2YLIDENEAMINO)ACETAMIDE
N(PROPAN2YLIDENEAMINO)ETHANAMIDE
NISOPROPYLIDENEACETOHYDRAZIDE
ZINC00091495
ZINC91495
InChI=1SC5H10N2Oc14(2)675(3)8h13H3(H78)
BBL003859
Synonyms: (10Z)-8,8-dimethyl-10-(piperidin-1-ylmethylidene)-2H,8H-pyrano[2,3-f]chromene-2,9(10H)-dione
Smiles: O=c1ccc2c(o1)c1c(cc2)OC(C(=O)/C/1=C\N1CCCCC1)(C)C
O=c1ccc2c(o1)c1c(cc2)OC(C(=O)C1=CN1CCCCC1)(C)C
ZINC04509615
ZINC73855622
(10Z)88DIMETHYL10(PIPERIDIN1YLMETHYLIDENE)2H8HPYRANO(23F)CHROMENE29(10H)DIONE
(10Z)88DIMETHYL10(PIPERIDIN1YLMETHYLIDENE)PYRANO(23F)CHROMENE29DIONE
299929478
88DIMETHYL10(PIPERIDYLMETHYLENE)8HPYRANO(23H)CHROMENE29DIONE
88DIMETHYL10PIPERIDIN1YLMETHYLENE10HPYRANO(23F)CHROMENE29DIONE
CC1(C(=O)C(=CN2CCCCC2)C3=C(O1)C=CC4=C3OC(=O)C=C4)C
InChI=1SC20H21NO4c120(2)19(23)14(1221104351121)1715(2520)86137916(22)2418(13)17h6912H351011H212H3b1412
BBL003860
Synonyms: dimethyl5-{[(3-amino-4-chlorophenyl)sulfonyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(c(c1)N)Cl
COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(c(c1)N)Cl
DIMETHYL5(((3AMINO4CHLOROPHENYL)SULFONYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5((3AMINO4CHLOROPHENYL)SULFONYLAMINO)BENZENE13DICARBOXYLATE
132797729
5(3AMINO4CHLOROBENZENESULFONYLAMINO)ISOPHTHALICACIDDIMETHYLESTER
METHYL5(((3AMINO4CHLOROPHENYL)SULFONYL)AMINO)3(METHOXYCARBONYL)BENZOATE
ZINC03877920
ZINC3877920
COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)N)C(=O)OC
InChI=1SC16H15ClN2O6Sc12415(20)9510(16(21)252)711(69)1926(2223)123413(17)14(18)812h3819H18H212H3
BBL003861
Synonyms: 3-ethyl-2-[(1E,3Z)-3-(3-ethyl-1,3-thiazolidin-2-ylidene)prop-1-en-1-yl]-4,5-dihydro-1,3-thiazol-3-ium
Smiles: CCN1CCS/C/1=C\C=C\C1=[N+](CC)CCS1
CCN1CCSC1=CC=CC1=(N+)(CC)CCS1
3ETHYL2(3(3ETHYL45DIHYDRO13THIAZOL3IUM2YL)PROP2ENYLIDENE)13THIAZOLIDINE
3ETHYL2(3(3ETHYLTHIAZOLIDIN2YLIDENE)1PROPENYL)45DIHYDROTHIAZOL3IUM
2((1E)3(3ETHYL(13THIAZOLIDIN2YLIDENE))PROP1ENYL)3ETHYL13THIAZOLINE
3ETHYL2((1E3Z)3(3ETHYL13THIAZOLIDIN2YLIDENE)PROP1EN1YL)45DIHYDRO13THIAZOL3IUM
3ETHYL2((E3E)3(3ETHYLTHIAZOLIDIN2YLIDENE)PROP1ENYL)2THIAZOLIN3IUMIODIDE
3ETHYL2((E3Z)3(3ETHYLTHIAZOLIDIN2YLIDENE)PROP1ENYL)2THIAZOLIN3IUMIODIDE
ZINC02512176
ZINC05030305
ZINC19537414
ZINC2512176
(2E)3ETHYL2((E)3(3ETHYL45DIHYDRO13THIAZOL3IUM2YL)PROP2ENYLIDENE)13THIAZOLIDINE
(2Z)3ETHYL2((E)3(3ETHYL45DIHYDRO13THIAZOL3IUM2YL)PROP2ENYLIDENE)13THIAZOLIDINE
(2Z)3ETHYL2((E)3(3ETHYL45DIHYDRO13THIAZOL3IUM2YL)PROP2ENYLIDENE)13THIAZOLIDINEIODIDE
(2Z)3ETHYL2((E)3(3ETHYL45DIHYDROTHIAZOL3IUM2YL)PROP2ENYLIDENE)THIAZOLIDINEIODIDE
3ethyl2((Z)3(3ethyl45dihydro13thiazol3ium2yl)prop2enylidene)13thiazolidine
CCN1CCSC1=CC=CC2=(N+)(CCS2)CC
InChI=1SC13H21N2S2c13148101612(14)6571315(42)9111713h57H34811H212H3q+1
BBL003862
Synonyms: (5Z)-5-[(phenylamino)methylidene]-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C\Nc2ccccc2)/C1=O
C=CCN1C(=S)SC(=CNc2ccccc2)C1=O
ZINC96429691
(5Z)5(ANILINOMETHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5((PHENYLAMINO)METHYLIDENE)3(PROP2EN1YL)2THIOXO13THIAZOLIDIN4ONE
3ALLYL5PHENYLAMINOMETHYLENE2THIOXOTHIAZOLIDIN4ONE
41523266
5((PHENYLAMINO)METHYLENE)3(2PROPENYL)2THIOXO4THIAZOLIDINONE
5((PHENYLAMINO)METHYLENE)3PROP2ENYL2THIOXO13THIAZOLIDIN4ONE
5(METHYLENE)32THIOXO4THIAZOLIDINONE
C=CCN1C(=O)C(=CNC2=CC=CC=C2)SC1=S
InChI=1SC13H12N2OS2c1281512(16)11(1813(15)17)914106435710h27914H18H2b119
BBL003863
Synonyms: 2-methyl-1-phenyl-1H-benzimidazole
Smiles: Cc1nc2c(n1c1ccccc1)cccc2
Cc1nc2c(n1c1ccccc1)cccc2
ZINC00090644
ZINC90644
1484395
1HBENZIMIDAZOLE2METHYL1PHENYL
1PHENYL2METHYL1HBENZIMIDAZOLE
1PHENYL2METHYLBENZIMIDAZOLE
1PHENYLBENZIMIDAZOLEDERIV51
2METHYL1PHENYL13BENZODIAZOLE
2METHYL1PHENYL1H13BENZODIAZOLE
2METHYL1PHENYL1HBENZIMIDAZOLE
2METHYL1PHENYL1HBENZO(D)IMIDAZOLE
2METHYL1PHENYL1HBENZOIMIDAZOLE
2METHYL1PHENYLBENZIMIDAZOLE
CC1=NC2=CC=CC=C2N1C3=CC=CC=C3
InChI=1SC14H12N2c11115139561014(13)16(11)127324812h210H1H3
BBL003864
Synonyms: ethyl2-{[(2E)-3-phenylprop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2ccccc2)sc2c1CCCC2
CCOC(=O)c1c(NC(=O)C=Cc2ccccc2)sc2c1CCCC2
ethyl2(((2E)3phenylprop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD00617107
ZINC000000822422
ZINC00822422
ZINC822422
76981776
ethyl2(((E)3phenylprop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=CC=C3
InChI=1SC20H21NO3Sc122420(23)181510671116(15)2519(18)2117(22)1312148435914h35891213H2671011H21H3(H2122)b1312+
BBL003865
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-4-chloroaniline
Smiles: Clc1ccc(cc1)NCn1nnc2c1cccc2
Clc1ccc(cc1)NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(4CHLOROPHENYL)AMINE
62001325
BENZOTRIAZOL1YLMETHYL(4CHLOROPHENYL)AMINE
MFCD00451363
N(1HBENZOTRIAZOL1YLMETHYL)4CHLOROANILINE
N(4CHLOROPHENYL)1HBENZOTRIAZOLE1METHANAMINE
N(BENZOTRIAZOL1YLMETHYL)4CHLOROANILINE
ZINC000000139112
ZINC00139112
ZINC139112
C1=CC=C2C(=C1)N=NN2CNC3=CC=C(C=C3)Cl
InChI=1SC13H11ClN4c14105711(8610)1591813421312(13)161718h1815H9H2
BBL003866
Synonyms: N-(2,4-dimethoxyphenyl)-3-nitrobenzamide
Smiles: COc1ccc(c(c1)OC)NC(=O)c1cccc(c1)[N+](=O)[O-]
COc1ccc(c(c1)OC)NC(=O)c1cccc(c1)(N+)(=O)(O)
152586931
MFCD00495099
N(24DIMETHOXYPHENYL)(3NITROPHENYL)CARBOXAMIDE
N(24DIMETHOXYPHENYL)3NITROBENZAMIDE
ZINC000000103241
ZINC00103241
ZINC103241
COC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))OC
InChI=1SC15H14N2O5c121126713(14(912)222)1615(18)1043511(810)17(19)20h39H12H3(H1618)
BBL003867
Synonyms: 4-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}benzoicacid
Smiles: COc1ccccc1N1CCN(CC1)Cc1ccc(cc1)C(=O)O
COc1ccccc1N1CCN(CC1)Cc1ccc(cc1)C(=O)O
358387254
4((4(2METHOXYPHENYL)PIPERAZIN1
4((4(2METHOXYPHENYL)PIPERAZIN1YL)METHYL)BENZOICACID
4((4(2METHOXYPHENYL)PIPERAZINYL)METHYL)BENZOICACID
4(4(2METHOXYPHENYL)PIPERAZIN1YLMETHYL)BENZOICACID
YL)METHYL)BENZOICACID
ZINC00075037
ZINC75037
4((4(2methoxyphenyl)piperazin1ium1yl)methyl)benzoate
COC1=CC=CC=C1N2CC(NH+)(CC2)CC3=CC=C(C=C3)C(=O)(O)
InChI=1SC19H22N2O3c12418532417(18)21121020(111321)14156816(9715)19(22)23h29H1014H21H3(H2223)
BBL003868
Synonyms: 2-(4-nitrophenyl)-4H-3,1-benzoxazin-4-one
Smiles: [O-][N+](=O)c1ccc(cc1)c1nc2ccccc2c(=O)o1
(O)(N+)(=O)c1ccc(cc1)c1nc2ccccc2c(=O)o1
16063051
2(4NITROPHENYL)31BENZOXAZIN4ONE
2(4NITROPHENYL)4H31BENZOXAZIN4ONE
2(4NITROPHENYL)4HBENZO(D)(13)OXAZIN4ONE
2(4NITROPHENYL)BENZ(D)(13)OXAZIN4ONE
2(4NITROPHENYL)BENZO(D)(13)OXAZIN4ONE
2(4NITROPHENYL)BENZO(D)13OXAZIN4ONE
2PNITROPHENYL31BENZOXAZIN4ONE
4H31BENZOXAZIN4ONE2(4NITROPHENYL)
ZINC00060263
ZINC60263
C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC14H8N2O4c171411312412(11)1513(2014)95710(869)16(18)19h18H
BBL003869
Synonyms: 3-(5-chloro-2-methyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
Smiles: Cc1sc2c([n+]1CCCS(=O)(=O)[O-])cc(cc2)Cl
Cc1sc2c((n+)1CCCS(=O)(=O)(O))cc(cc2)Cl
5CHLORO2METHYL3BENZOTHIAZOLIUMINNERSALT
65287049
MFCD00186325
ZINC000002831196
ZINC02831196
3(5CHLORO2METHYL13BENZOTHIAZOL3IUM3YL)PROPANE1SULFONATE
3(5CHLORO2METHYLBENZOTHIAZOL3YL)PROPANESULFONICACID
CC1=(N+)(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)(O)
InChI=1SC11H12ClNO3S2c1813(52618(1415)16)1079(12)3411(10)178h347H256H21H3
BBL003870
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-2-methylaniline
Smiles: Cc1ccccc1NCn1nnc2c1cccc2
Cc1ccccc1NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(2METHYLPHENYL)AMINE
62001358
BENZOTRIAZOL1YLMETHYLOTOLYLAMINE
N(1HBENZOTRIAZOL1YLMETHYL)2METHYLANILINE
N(1HBENZOTRIAZOLE1YLMETHYL)2METHYLANILINE
N(BENZOTRIAZOL1YLMETHYL)2METHYLANILINE
ZINC00366072
ZINC366072
CC1=CC=CC=C1NCN2C3=CC=CC=C3N=N2
InChI=1SC14H14N4c111623712(11)15101814954813(14)161718h2915H10H21H3
BBL003871
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-3-methylaniline
Smiles: Cc1cccc(c1)NCn1nnc2c1cccc2
Cc1cccc(c1)NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(3METHYLPHENYL)AMINE
62001369
BENZOTRIAZOL1YLMETHYLMTOLYLAMINE
N(1H123BENZOTRIAZOL1YLMETHYL)3METHYLANILINE
N(1HBENZOTRIAZOL1YLMETHYL)3METHYLANILINE
N(3METHYLPHENYL)1HBENZOTRIAZOLE1METHANAMINE
N(BENZOTRIAZOL1YLMETHYL)3METHYLANILINE
ZINC00366065
ZINC366065
CC1=CC(=CC=C1)NCN2C3=CC=CC=C3N=N2
InChI=1SC14H14N4c11154612(911)15101814832713(14)161718h2915H10H21H3
BBL003872
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-4-bromoaniline
Smiles: Brc1ccc(cc1)NCn1nnc2c1cccc2
Brc1ccc(cc1)NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(4BROMOPHENYL)AMINE
144583006
BENZOTRIAZOL1YLMETHYL(4BROMOPHENYL)AMINE
MFCD00451360
N(1HBENZOTRIAZOL1YLMETHYL)4BROMOANILINE
N(BENZOTRIAZOL1YLMETHYL)4BROMOANILINE
ZINC000000366077
ZINC00366077
ZINC366077
C1=CC=C2C(=C1)N=NN2CNC3=CC=C(C=C3)Br
InChI=1SC13H11BrN4c14105711(8610)1591813421312(13)161718h1815H9H2
BBL003873
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-2-bromoaniline
Smiles: Brc1ccccc1NCn1nnc2c1cccc2
Brc1ccccc1NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(2BROMOPHENYL)AMINE
162885247
BENZOTRIAZOL1YLMETHYL(2BROMOPHENYL)AMINE
MFCD00451358
N(1HBENZOTRIAZOL1YLMETHYL)2BROMOANILINE
N(BENZOTRIAZOL1YLMETHYL)2BROMOANILINE
ZINC000000363069
ZINC00363069
ZINC363069
C1=CC=C2C(=C1)N=NN2CNC3=CC=CC=C3Br
InChI=1SC13H11BrN4c1410512611(10)1591813843712(13)161718h1815H9H2
BBL003874
Synonyms: 3-[(1H-benzotriazol-1-ylmethyl)amino]benzoicacid
Smiles: OC(=O)c1cccc(c1)NCn1nnc2c1cccc2
OC(=O)c1cccc(c1)NCn1nnc2c1cccc2
ZINC000000366062
ZINC366062
MFCD00426878
3((1HBENZOTRIAZOL1YLMETHYL)AMINO)BENZOICACID
3((BENZOTRIAZOL1YLMETHYL)AMINO)BENZOICACID
3((BENZOTRIAZOLYLMETHYL)AMINO)BENZOICACID
3(BENZOTRIAZOL1YLMETHYLAMINO)BENZOICACID
62001427
C1=CC=C2C(=C1)N=NN2CNC3=CC=CC(=C3)C(=O)O
InChI=1SC14H12N4O2c1914(20)1043511(810)1591813721612(13)161718h1815H9H2(H1920)
BBL003875
Synonyms: N-(2-nitrophenyl)-N-(phenylsulfonyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-]
OC(=O)CN(S(=O)(=O)c1ccccc1)c1ccccc1(N+)(=O)(O)
ZINC4974100
N(2NITROPHENYL)N(PHENYLSULFONYL)GLYCINE
(BENZENESULFONYL(2NITROPHENYL)AMINO)ACETICACID
2((2NITROPHENYL)(PHENYLSULFONYL)AMINO)ACETICACID
2(N(2NITROPHENYL)BENZENESULFONAMIDO)ACETICACID
2(N(BENZENESULFONYL)2NITROANILINO)ACETICACID
330858554
C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C2=CC=CC=C2(N+)(=O)(O)
InChI=1SC14H12N2O6Sc1714(18)1015(12845913(12)16(19)20)23(2122)116213711h19H10H2(H1718)
BBL003876
Synonyms: 2-methyl-3,5-dinitrobenzamide
Smiles: [O-][N+](=O)c1cc(C(=O)N)c(c(c1)[N+](=O)[O-])C
(O)(N+)(=O)c1cc(C(=O)N)c(c(c1)(N+)(=O)(O))C
148016
2METHYL35DINITROBENZAMIDE
35DINITRO2METHYLBENZAMIDE
35DINITROORTHOTOLUAMIDE
35DINITROOTOLUAMIDE
BENZAMIDE2METHYL35DINITRO
COCCIDINEA
DINITROTOLUAMIDE
DINITROTOLUAMIDE(RELATED)
METHYLDINITROBENZAMIDE
METHYLDINITROBENZAMIDE(RELATED)
MFCD00072065
OTOLUAMIDE35DINITRO
ZINC000002040950
ZINC02040950
ZINC2040950
CC1=C(C=C(C=C1C(=O)N)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC8H7N3O5c146(8(9)12)25(10(13)14)37(4)11(15)16h23H1H3(H2912)
BBL003877
Synonyms: 3-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Smiles: O=C1CCCc2c1c(n[nH]2)c1ccccc1
O=C1CCCc2c1c(n(nH)2)c1ccccc1
3phenyl1567tetrahydro4Hindazol4one
ZINC12324002
3PHENYL1H567TRIHYDROINDAZOL4ONE
3PHENYL67DIHYDRO1HINDAZOL4(5H)ONE
96546382
3phenyl1567tetrahydroindazol4one
C1CC2=C(C(=O)C1)C(=NN2)C3=CC=CC=C3
InChI=1SC13H12N2Oc16118471012(11)13(151410)9521369h1356H478H2(H1415)
BBL003878
Synonyms: methyl[6-oxo-2-(piperidin-1-yl)-1,4,5,6-tetrahydropyrimidin-5-yl]acetate
Smiles: COC(=O)CC1CN=C(NC1=O)N1CCCCC1
COC(=O)CC1CN=C(NC1=O)N1CCCCC1
methyl(6oxo2(piperidin1yl)1456tetrahydropyrimidin5yl)acetate
METHYL2(4OXO2(PIPERIDIN1YL)56DIHYDRO3HPYRIMIDIN5YL)ACETATE
METHYL2(4OXO2PIPERIDYL356TRIHYDROPYRIMIDIN5YL)ACETATE
MFCD11058050
ZINC000014988622
ZINC000014988625
1020046369
methyl2(6oxo2piperidin1yl45dihydro1Hpyrimidin5yl)acetate
COC(=O)CC1CN=C(NC1=O)N2CCCCC2
InChI=1SC12H19N3O3c11810(16)7981312(1411(9)17)155324615h9H28H21H3(H131417)
BBL003879
Synonyms: ethyl7-amino-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)c1cnc2n(c1N)nc(n2)C(F)(F)F
CCOC(=O)c1cnc2n(c1N)nc(n2)C(F)(F)F
ETHYL7AMINO2(TRIFLUOROMETHYL)(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7AMINO2(TRIFLUOROMETHYL)8HYDRO124TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
MFCD05858386
ZINC000008558861
ZINC08558861
ZINC100850183
ZINC8558861
(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLICACID7AMINO2TRIFLUOROMETHYLETHYLESTER
704877281
CCOC(=O)C1=C(N2C(=NC(=N2)C(F)(F)F)N=C1)N
InChI=1SC9H8F3N5O2c12196(18)43148157(9(1011)12)1617(8)5(4)13h3H213H21H3
BBL003880
Synonyms: N-(3,4-difluorophenyl)-1,3,5-triazine-2,4-diamine
Smiles: Nc1ncnc(n1)Nc1ccc(c(c1)F)F
Nc1ncnc(n1)Nc1ccc(c(c1)F)F
ZINC000020153868
ZINC20153868
MFCD11058100
N(34DIFLUOROPHENYL)135TRIAZINE24DIAMINE
N(4AMINO135TRIAZIN2YL)N(34DIFLUOROPHENYL)AMINE
(4AMINO(135TRIAZIN2YL))(34DIFLUOROPHENYL)AMINE
1030476846
2N(34DIFLUOROPHENYL)135TRIAZINE24DIAMINE
C1=CC(=C(C=C1NC2=NC=NC(=N2)N)F)F
InChI=1SC9H7F2N5c106215(37(6)11)159144138(12)169h14H(H31213141516)
BBL003881
Synonyms: 2-methyl-5,6,7,8-tetrahydro-4H-[1]benzothieno[2,3-d][1,3]oxazin-4-one
Smiles: Cc1oc(=O)c2c(n1)sc1c2CCCC1
Cc1oc(=O)c2c(n1)sc1c2CCCC1
2methyl5678tetrahydro4H(1)benzothieno(23d)(13)oxazin4one
13130477
ZINC00040339
ZINC40339
2methyl5678tetrahydro(1)benzothiolo(23d)(13)oxazin4one
CC1=NC2=C(C3=C(S2)CCCC3)C(=O)O1
InChI=1SC11H11NO2Sc1612109(11(13)146)742358(7)1510h25H21H3
BBL003882
Synonyms: ethyl4-[(2-fluorophenyl)carbamothioyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=S)Nc1ccccc1F
CCOC(=O)N1CCN(CC1)C(=S)Nc1ccccc1F
ETHYL4(((2FLUOROPHENYL)AMINO)THIOXOMETHYL)PIPERAZINECARBOXYLATE
ETHYL4((2FLUOROPHENYL)CARBAMOTHIOYL)PIPERAZINE1CARBOXYLATE
ZINC03326981
ZINC3326981
710309221
CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2F
InChI=1SC14H18FN3O2Sc122014(19)189717(81018)13(21)1612643511(12)15h36H2710H21H3(H1621)
BBL003883
Synonyms: methyl4-(4-formylphenoxy)butanoate
Smiles: COC(=O)CCCOc1ccc(cc1)C=O
COC(=O)CCCOc1ccc(cc1)C=O
117846669
4(4FORMYLPHENOXY)BUTYRICACIDMETHYLESTER
METHYL4(4FORMYLPHENOXY)BUTANOATE
ZINC19737432
COC(=O)CCCOC1=CC=C(C=C1)C=O
InChI=1SC12H14O4c11512(14)32816116410(913)5711h479H238H21H3
BBL003884
Synonyms: butyl4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1C(=O)C=CC1=O
CCCCOC(=O)c1ccc(cc1)N1C(=O)C=CC1=O
174603737
BENZOICACID4(25DIHYDRO25DIOXO1HPYRROL1YL)BUTYLESTER
BUTYL4(25DIOXO25DIHYDRO1HPYRROL1YL)BENZOATE
BUTYL4(25DIOXOAZOLINYL)BENZOATE
BUTYL4(25DIOXOPYRROL1YL)BENZOATE
MFCD03620181
N(4BUTOXYCARBONYLPHENYL)MALEIMIDE
ZINC000001892842
ZINC01892842
ZINC1892842
CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C=CC2=O
InChI=1SC15H15NO4c123102015(19)114612(7511)1613(17)8914(16)18h49H2310H21H3
BBL003885
Synonyms: 1-(2-methoxy-5-methylphenyl)-1H-pyrrole-2,5-dione
Smiles: COc1ccc(cc1N1C(=O)C=CC1=O)C
COc1ccc(cc1N1C(=O)C=CC1=O)C
1(2METHOXY5METHYLPHENYL)1HPYRROLE25DIONE
1(2METHOXY5METHYLPHENYL)25DIHYDRO1HPYRROLE25DIONE
1(2METHOXY5METHYLPHENYL)AZOLINE25DIONE
1(2METHOXY5METHYLPHENYL)PYRROLE25DIONE
199464954
1HPYRROLE25DIONE1(2METHOXY5METHYLPHENYL)
MFCD00030663
ZINC000002155929
ZINC02155929
ZINC2155929
CC1=CC(=C(C=C1)OC)N2C(=O)C=CC2=O
InChI=1SC12H11NO3c183410(162)9(78)1311(14)5612(13)15h37H12H3
BBL003886
Synonyms: N-methyl-N-(4-methylphenyl)ethane-1,2-diamine
Smiles: NCCN(c1ccc(cc1)C)C
NCCN(c1ccc(cc1)C)C
NMETHYLN(4METHYLPHENYL)ETHANE12DIAMINE
ZINC20239298
54755441
N(2AMINOETHYL)N4DIMETHYLANILINE
CC1=CC=C(C=C1)N(C)CCN
InChI=1SC10H16N2c193510(649)12(2)8711h36H7811H212H3
BBL003887
Synonyms: 1-(2,4-dimethylphenyl)-2-methylpropan-1-amine
Smiles: CC(C(c1ccc(cc1C)C)N)C
CC(C(c1ccc(cc1C)C)N)C
1021121141
1(24DIMETHYLPHENYL)2METHYLPROPAN1AMINE
CC1=CC(=C(C=C1)C(C(C)C)N)C
InChI=1SC12H19Nc18(2)12(13)11659(3)710(11)4h5812H13H214H3
BBL003888
Synonyms: 4-[2-(phenylsulfanyl)ethoxy]benzoicacid
Smiles: OC(=O)c1ccc(cc1)OCCSc1ccccc1
OC(=O)c1ccc(cc1)OCCSc1ccccc1
ZINC11861415
4(2(PHENYLSULFANYL)ETHOXY)BENZOICACID
938308077
4(2phenylsulfanylethoxy)benzoicacid
C1=CC=C(C=C1)SCCOC2=CC=C(C=C2)C(=O)O
InChI=1SC15H14O3Sc1615(17)126813(9712)18101119144213514h19H1011H2(H1617)
BBL003889
Synonyms: 4-[(4-benzylpiperidin-1-yl)methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)CN1CCC(CC1)Cc1ccccc1
OC(=O)c1ccc(cc1)CN1CCC(CC1)Cc1ccccc1
ZINC00132470
ZINC132470
330859353
4((4BENZYLPIPERIDIN1IUM1YL)METHYL)BENZOATE
4((4BENZYLPIPERIDIN1YL)METHYL)BENZOICACID
4((4BENZYLPIPERIDYL)METHYL)BENZOICACID
C1CN(CCC1CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)O
InChI=1SC20H23NO2c2220(23)198618(7919)1521121017(111321)14164213516h1917H1015H2(H2223)
BBL003890
Synonyms: 5-(2-aminoethyl)-1,3,4-thiadiazol-2-amine
Smiles: NCCc1nnc(s1)N
NCCc1nnc(s1)N
ZINC000020206027
ZINC20206027
MFCD11109392
2AMINO5(2AMINOETHYL)134THIADIAZOLE
5(2AMINOETHYL)134THIADIAZOL2AMINE
5(2AMINOETHYL)134THIADIAZOL2AMINEDIHYDROCHLORIDE
5(2AMINOETHYL)134THIADIAZOL2YLAMINEDIHYDROCHLORIDE
5(2AMINOETHYL)134THIADIAZOLE2YLAMINE
5AMINO134THIADIAZOLE2(ETHANAMINE)
5AMINO134THIADIAZOLE2ETHANAMINE
74784477
C(CN)C1=NN=C(S1)N
InChI=1SC4H8N4Sc5213784(6)93h125H2(H268)
BBL003891
Synonyms: 4-nitro-2-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}phenol
Smiles: Oc1ccc(cc1CSc1nnnn1c1ccccc1)[N+](=O)[O-]
Oc1ccc(cc1CSc1nnnn1c1ccccc1)(N+)(=O)(O)
ZINC34772752
4NITRO2(((1PHENYL1HTETRAZOL5YL)SULFANYL)METHYL)PHENOL
4NITRO2((1PHENYLTETRAZOL5YL)SULFANYLMETHYL)PHENOL
117456458
C1=CC=C(C=C1)N2C(=NN=N2)SCC3=C(C=CC(=C3)(N+)(=O)(O))O
InChI=1SC14H11N5O3Sc20137612(19(21)22)810(13)9231415161718(14)114213511h1820H9H2
BBL003892
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-3-chloroaniline
Smiles: Clc1cccc(c1)NCn1nnc2c1cccc2
Clc1cccc(c1)NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(3CHLOROPHENYL)AMINE
62001314
MFCD00451362
N(1HBENZOTRIAZOL1YLMETHYL)3CHLOROANILINE
N(BENZOTRIAZOL1YLMETHYL)3CHLOROANILINE
ZINC000000347777
ZINC00347777
ZINC347777
C1=CC=C2C(=C1)N=NN2CNC3=CC(=CC=C3)Cl
InChI=1SC13H11ClN4c141043511(810)1591813721612(13)161718h1815H9H2
BBL003893
Synonyms: (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)(2,4-dichlorophenyl)methanone
Smiles: Clc1ccc(c(c1)Cl)C(=O)c1sc2c(c1N)c(C)cc(n2)C
Clc1ccc(c(c1)Cl)C(=O)c1sc2c(c1N)c(C)cc(n2)C
299438485
3AMINO46DIMETHYLTHIOPHENO(23B)PYRIDIN2YL24DICHLOROPHENYLKETONE
MFCD01952637
ZINC000000947938
ZINC00947938
ZINC947938
(3AMINO46DIMETHYLTHIENO(23B)PYRIDIN2YL)(24DICHLOROPHENYL)METHANONE
CC1=CC(=NC2=C1C(=C(S2)C(=O)C3=C(C=C(C=C3)Cl)Cl)N)C
InChI=1SC16H12Cl2N2OSc1758(2)201612(7)13(19)15(2216)14(21)10439(17)611(10)18h36H19H212H3
BBL003894
Synonyms: (1E)-1-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)propan-2-one
Smiles: CCn1/c(=C\C(=O)C)/sc2c1cccc2
CCn1c(=CC(=O)C)sc2c1cccc2
ZINC100199745
(1E)1(3ETHYL13BENZOTHIAZOL2(3H)YLIDENE)2PROPANONE
(1E)1(3ETHYL13BENZOTHIAZOL2(3H)YLIDENE)PROPAN2ONE
(1E)1(3ETHYL13BENZOTHIAZOL2YLIDENE)PROPAN2ONE
1(3ETHYL13BENZOTHIAZOL2(3H)YLIDENE)ACETONE
1082698756
2(ACETYLMETHYLENE)3ETHYLBENZOTHIAZOLINE
CCN1C2=CC=CC=C2SC1=CC(=O)C
InChI=1SC12H13NOSc131310645711(10)1512(13)89(2)14h48H3H212H3b128+
BBL003895
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-2-nitroaniline
Smiles: [O-][N+](=O)c1ccccc1NCn1nnc2c1cccc2
(O)(N+)(=O)c1ccccc1NCn1nnc2c1cccc2
202264855
BENZOTRIAZOL1YLMETHYL(2NITROPHENYL)AMINE
N(1HBENZOTRIAZOL1YLMETHYL)2NITROANILINE
N(BENZOTRIAZOL1YLMETHYL)2NITROANILINE
ZINC03877932
ZINC3877932
(BENZOTRIAZOLYLMETHYL)(2NITROPHENYL)AMINE
C1=CC=C2C(=C1)N=NN2CNC3=CC=CC=C3(N+)(=O)(O)
InChI=1SC13H11N5O2c1918(20)13841510(13)1491712732611(12)151617h1814H9H2
BBL003896
Synonyms: N-(1H-benzotriazol-1-ylmethyl)-2-chloroaniline
Smiles: Clc1ccccc1NCn1nnc2c1cccc2
Clc1ccccc1NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(2CHLOROPHENYL)AMINE
62001303
BENZOTRIAZOL1YLMETHYL(2CHLOROPHENYL)AMINE
N(1HBENZOTRIAZOL1YLMETHYL)2CHLOROANILINE
N(BENZOTRIAZOL1YLMETHYL)2CHLOROANILINE
ZINC00086846
ZINC86846
C1=CC=C2C(=C1)N=NN2CNC3=CC=CC=C3Cl
InChI=1SC13H11ClN4c1410512611(10)1591813843712(13)161718h1815H9H2
BBL003897
Synonyms: N-(1H-benzotriazol-1-ylmethyl)biphenyl-2-amine
Smiles: c1ccc(cc1)c1ccccc1NCn1nnc2c1cccc2
c1ccc(cc1)c1ccccc1NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)(2PHENYLPHENYL)AMINE
62001392
BENZOTRIAZOL1YLMETHYLBIPHENYL2YLAMINE
MFCD00397244
N(1HBENZOTRIAZOL1YLMETHYL)BIPHENYL2AMINE
N(BENZOTRIAZOL1YLMETHYL)2PHENYLANILINE
ZINC000000352725
ZINC00352725
ZINC352725
C1=CC=C(C=C1)C2=CC=CC=C2NCN3C4=CC=CC=C4N=N3
InChI=1SC19H16N4c12815(931)1610451117(16)2014231913761218(19)212223h11320H14H2
BBL003898
Synonyms: 1-ethyl-2-methyl-1H-benzimidazole-5-carbonitrile
Smiles: N#Cc1ccc2c(c1)nc(n2CC)C
N#Cc1ccc2c(c1)nc(n2CC)C
ZINC00126185
ZINC126185
1ETHYL2METHYL13BENZODIAZOLE5CARBONITRILE
1ETHYL2METHYL1H13BENZODIAZOLE5CARBONITRILE
1ETHYL2METHYL1HBENZIMIDAZOLE5CARBONITRILE
1ETHYL2METHYL1HBENZO(D)IMIDAZOLE5CARBONITRILE
1ETHYL2METHYL5CYANOBENZIMIDAZOLE
1ETHYL2METHYL5CYANOBENZO(D)IMIDAZOLE
1ETHYL2METHYLBENZIMIDAZOLE5CARBONITRILE
62306085
CCN1C(=NC2=C1C=CC(=C2)C#N)C
InChI=1SC11H11N3c13148(2)131069(712)4511(10)14h46H3H212H3
BBL003899
Synonyms: 4-[(1H-benzotriazol-1-ylmethyl)amino]benzoicacid
Smiles: OC(=O)c1ccc(cc1)NCn1nnc2c1cccc2
OC(=O)c1ccc(cc1)NCn1nnc2c1cccc2
ZINC225152
4(((1HBENZO(D)(123)TRIAZOL1YL)METHYL)AMINO)BENZOICACID
4((1HBENZOTRIAZOL1YLMETHYL)AMINO)BENZOICACID
4((BENZOTRIAZOLYLMETHYL)AMINO)BENZOICACID
4(BENZOTRIAZOL1YLMETHYLAMINO)BENZOICACID
62001438
C1=CC=C2C(=C1)N=NN2CNC3=CC=C(C=C3)C(=O)O
InChI=1SC14H12N4O2c1914(20)105711(8610)1591813421312(13)161718h1815H9H2(H1920)
BBL003900
Synonyms: 1-{2-[(1H-benzotriazol-1-ylmethyl)amino]phenyl}ethanone
Smiles: CC(=O)c1ccccc1NCn1nnc2c1cccc2
CC(=O)c1ccccc1NCn1nnc2c1cccc2
1(2((1HBENZOTRIAZOL1YLMETHYL)AMINO)PHENYL)ETHANONE
1(2(BENZOTRIAZOL1YLMETHYLAMINO)PHENYL)ETHANONE
1ACETYL2((BENZOTRIAZOLYLMETHYL)AMINO)BENZENE
331657842
MFCD00426933
ZINC000000363074
ZINC00363074
ZINC363074
CC(=O)C1=CC=CC=C1NCN2C3=CC=CC=C3N=N2
InChI=1SC15H14N4Oc111(20)12623713(12)16101915954814(15)171819h2916H10H21H3
BBL003901
Synonyms: 5-(3-methylphenyl)cyclohexane-1,3-dione
Smiles: O=C1CC(=O)CC(C1)c1cccc(c1)C
O=C1CC(=O)CC(C1)c1cccc(c1)C
ZINC100014329
5(3METHYLPHENYL)CYCLOHEXANE13DIONE
5(MTOLYL)CYCLOHEXANE13DIONE
5MTOLYLCYCLOHEXANE13DIONE
762243265
CC1=CC=CC(=C1)C2CC(=O)CC(=O)C2
InChI=1SC13H14O2c1932410(59)11612(14)813(15)711h2511H68H21H3
BBL003902
Synonyms: 3-(2-carboxyethyl)-5-methoxy-2-methyl-1,3-benzothiazol-3-ium
Smiles: Cc1sc2c([n+]1CCC(=O)O)cc(cc2)OC
Cc1sc2c((n+)1CCC(=O)O)cc(cc2)OC
ZINC294942
3(2CARBOXYETHYL)5METHOXY2METHYL13BENZOTHIAZOL3IUM
3(2CARBOXYETHYL)5METHOXY2METHYLBENZOTHIAZOL3IUM
3(5METHOXY2METHYL13BENZOTHIAZOL3IUM3YL)PROPANOICACID
CC1=(N+)(C2=C(S1)C=CC(=C2)OC)CCC(=O)O
InChI=1SC12H13NO3Sc1813(6512(14)15)1079(162)3411(10)178h347H56H212H3p+1
BBL003903
Synonyms: 1-[4-(methylsulfonyl)phenyl]propan-1-one
Smiles: CCC(=O)c1ccc(cc1)S(=O)(=O)C
CCC(=O)c1ccc(cc1)S(=O)(=O)C
ZINC04186911
ZINC4186911
1(4(METHYLSULFONYL)PHENYL)1PROPANONE
1(4(METHYLSULFONYL)PHENYL)PROPAN1ONE
1(4METHANESULFONYLPHENYL)PROPAN1ONE
1(4METHYLSULFONYLPHENYL)PROPAN1ONE
69566956
BBL003904
Synonyms: 3-(2-methyl-2,3-dihydro-1H-indol-1-yl)propan-1-amine
Smiles: NCCCN1C(C)Cc2c1cccc2
NCCCN1C(C)Cc2c1cccc2
1016529137
3(2METHYL23DIHYDRO1HINDOL1YL)PROPAN1
3(2METHYL23DIHYDRO1HINDOL1YL)PROPAN1AMINE
3(2methyl23dihydroindol1yl)propan1amine
CC1CC2=CC=CC=C2N1CCCN
InChI=1SC12H18N2c110911523612(11)14(10)84713h235610H47913H21H3
BBL003905
Synonyms: 3-[3-(propan-2-yloxy)phenyl]propan-1-amine
Smiles: NCCCc1cccc(c1)OC(C)C
NCCCc1cccc(c1)OC(C)C
ZINC20216378
(3(3ISOPROPOXYPHENYL)PROPYL)AMINE
3(3(PROPAN2YLOXY)PHENYL)PROPAN1AMINE
937661875
3(3propan2yloxyphenyl)propan1amine
CC(C)OC1=CC=CC(=C1)CCCN
InChI=1SC12H19NOc110(2)141273511(912)64813h357910H46813H212H3
BBL003906
Synonyms: 2-[(4-chlorophenyl)(methylsulfonyl)amino]butanoicacid
Smiles: CCC(N(S(=O)(=O)C)c1ccc(cc1)Cl)C(=O)O
CCC(N(S(=O)(=O)C)c1ccc(cc1)Cl)C(=O)O
1218722338
2((4CHLOROPHENYL)(METHYLSULFONYL)AMINO)BUTANOICACID
2(N(4CHLOROPHENYL)METHANESULFONAMIDO)BUTANOIC
2(4chloroNmethylsulfonylanilino)butanoicacid
CCC(C(=O)O)N(C1=CC=C(C=C1)Cl)S(=O)(=O)C
InChI=1SC11H14ClNO4Sc1310(11(14)15)13(18(216)17)9648(12)579h4710H3H212H3(H1415)
BBL003907
Synonyms: 2-[(4-methylphenyl)(methylsulfonyl)amino]butanoicacid
Smiles: CCC(N(S(=O)(=O)C)c1ccc(cc1)C)C(=O)O
CCC(N(S(=O)(=O)C)c1ccc(cc1)C)C(=O)O
1218292364
2((4METHYLPHENYL)(METHYLSULFONYL)AMINO)BUTANOICACID
2(N(4METHYLPHENYL)METHANESULFONAMIDO)BUTANOICACID
2(4methylNmethylsulfonylanilino)butanoicacid
CCC(C(=O)O)N(C1=CC=C(C=C1)C)S(=O)(=O)C
InChI=1SC12H17NO4Sc1411(12(14)15)13(18(316)17)10759(2)6810h5811H4H213H3(H1415)
BBL003908
Synonyms: 2-[(methylsulfonyl)(phenyl)amino]butanoicacid
Smiles: CCC(N(S(=O)(=O)C)c1ccccc1)C(=O)O
CCC(N(S(=O)(=O)C)c1ccccc1)C(=O)O
1218256348
2((METHYLSULFONYL)(PHENYL)AMINO)BUTANOICACID
2(NPHENYLMETHANESULFONAMIDO)BUTANOICACID
2(Nmethylsulfonylanilino)butanoicacid
CCC(C(=O)O)N(C1=CC=CC=C1)S(=O)(=O)C
InChI=1SC11H15NO4Sc1310(11(13)14)12(17(215)16)9754689h4810H3H212H3(H1314)
BBL003909
Synonyms: 2-[(3-chlorophenyl)(methylsulfonyl)amino]butanoicacid
Smiles: CCC(N(S(=O)(=O)C)c1cccc(c1)Cl)C(=O)O
CCC(N(S(=O)(=O)C)c1cccc(c1)Cl)C(=O)O
1218725155
2((3CHLOROPHENYL)(METHYLSULFONYL)AMINO)BUTANOICACID
2(N(3CHLOROPHENYL)METHANESULFONAMIDO)BUTANOIC
2(3chloroNmethylsulfonylanilino)butanoicacid
CCC(C(=O)O)N(C1=CC(=CC=C1)Cl)S(=O)(=O)C
InChI=1SC11H14ClNO4Sc1310(11(14)15)13(18(216)17)96458(12)79h4710H3H212H3(H1415)
BBL003910
Synonyms: 2-[(3-fluorophenyl)(methylsulfonyl)amino]butanoicacid
Smiles: CCC(N(S(=O)(=O)C)c1cccc(c1)F)C(=O)O
CCC(N(S(=O)(=O)C)c1cccc(c1)F)C(=O)O
1218050317
2((3FLUOROPHENYL)(METHYLSULFONYL)AMINO)BUTANOICACID
2(N(3FLUOROPHENYL)METHANESULFONAMIDO)BUTANOIC
2(3fluoroNmethylsulfonylanilino)butanoicacid
CCC(C(=O)O)N(C1=CC(=CC=C1)F)S(=O)(=O)C
InChI=1SC11H14FNO4Sc1310(11(14)15)13(18(216)17)96458(12)79h4710H3H212H3(H1415)
BBL003911
Synonyms: N-(dimethylsulfamoyl)-N-(2-fluorophenyl)glycine
Smiles: OC(=O)CN(S(=O)(=O)N(C)C)c1ccccc1F
OC(=O)CN(S(=O)(=O)N(C)C)c1ccccc1F
ZINC39315689
N(DIMETHYLSULFAMOYL)N(2FLUOROPHENYL)GLYCINE
1207326882
2((DIMETHYLSULFAMOYL)(2FLUOROPHENYL)AMINO)ACETIC
2(N(dimethylsulfamoyl)2fluoroanilino)aceticacid
CN(C)S(=O)(=O)N(CC(=O)O)C1=CC=CC=C1F
InChI=1SC10H13FN2O4Sc112(2)18(1617)13(710(14)15)964358(9)11h36H7H212H3(H1415)
BBL003912
Synonyms: (9H-fluoren-9-ylsulfanyl)aceticacid
Smiles: OC(=O)CSC1c2ccccc2c2c1cccc2
OC(=O)CSC1c2ccccc2c2c1cccc2
ZINC39315690
(9HFLUOREN9YLSULFANYL)ACETICACID
2(9HFLUOREN9YLSULFANYL)ACETICACID
C1=CC=C2C(=C1)C(C3=CC=CC=C32)SCC(=O)O
InChI=1SC15H12O2Sc1614(17)9181512731510(12)11624813(11)15h1815H9H2(H1617)
BBL003913
Synonyms: methyl4-[4-(hydroxymethyl)phenoxy]butanoate
Smiles: OCc1ccc(cc1)OCCCC(=O)OC
OCc1ccc(cc1)OCCCC(=O)OC
ZINC37286916
1096301244
METHYL4(4(HYDROXYMETHYL)PHENOXY)BUTANOATE
COC(=O)CCCOC1=CC=C(C=C1)CO
InChI=1SC12H16O4c11512(14)32816116410(913)5711h4713H2389H21H3
BBL003914
Synonyms: 4-{[(2,5-dimethylphenyl)(methylsulfonyl)amino]methyl}benzoicacid
Smiles: Cc1ccc(c(c1)N(S(=O)(=O)C)Cc1ccc(cc1)C(=O)O)C
Cc1ccc(c(c1)N(S(=O)(=O)C)Cc1ccc(cc1)C(=O)O)C
ZINC39315708
1207326871
4(((25DIMETHYLPHENYL)(METHYLSULFONYL)AMINO)METHYL)BENZOICACID
4((N(25DIMETHYLPHENYL)METHANESULFONAMIDO)METHYL)BENZOICACID
4((25dimethylNmethylsulfonylanilino)methyl)benzoicacid
CC1=CC(=C(C=C1)C)N(CC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C
InChI=1SC17H19NO4Sc1124513(2)16(1012)18(23(321)22)11146815(9714)17(19)20h410H11H213H3(H1920)
BBL003915
Synonyms: 4-{[(4-ethoxyphenyl)(methylsulfonyl)amino]methyl}benzoicacid
Smiles: CCOc1ccc(cc1)N(S(=O)(=O)C)Cc1ccc(cc1)C(=O)O
CCOc1ccc(cc1)N(S(=O)(=O)C)Cc1ccc(cc1)C(=O)O
ZINC39315706
1207326893
4(((4ETHOXYPHENYL)(METHYLSULFONYL)AMINO)METHYL)BENZOICACID
4((N(4ETHOXYPHENYL)METHANESULFONAMIDO)METHYL)BENZOIC
4((4ethoxyNmethylsulfonylanilino)methyl)benzoicacid
CCOC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C
InChI=1SC17H19NO5Sc13231610815(91116)18(24(221)22)12134614(7513)17(19)20h411H312H212H3(H1920)
BBL003916
Synonyms: 4-{[(3,5-dichlorophenyl)(methylsulfonyl)amino]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CN(S(=O)(=O)C)c1cc(Cl)cc(c1)Cl
OC(=O)c1ccc(cc1)CN(S(=O)(=O)C)c1cc(Cl)cc(c1)Cl
ZINC39315705
DICHLOROPHENYL)METHANESULFONAMIDO)METHYL)BENZOIC
1207326906
4(((35DICHLOROPHENYL)(METHYLSULFONYL)AMINO)METHYL)BENZOICACID
4((35dichloroNmethylsulfonylanilino)methyl)benzoicacid
CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)O)C2=CC(=CC(=C2)Cl)Cl
InChI=1SC15H13Cl2NO4Sc123(2122)18(14712(16)613(17)814)9102411(5310)15(19)20h28H9H21H3(H1920)
BBL003917
Synonyms: methyl4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-carboxylate
Smiles: COC(=O)C1=C(SCC1=O)Nc1cccc(c1)C(F)(F)F
COC(=O)C1=C(SCC1=O)Nc1cccc(c1)C(F)(F)F
431072843
METHYL4OXO2((3(TRIFLUOROMETHYL)PHENYL)AMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
METHYL4OXO2(3(TRIFLUOROMETHYL)ANILINO)THIOPHENE3CARBOXYLATE
MFCD02924623
ZINC000000301703
ZINC00301703
ZINC301703
COC(=O)C1=C(SCC1=O)NC2=CC=CC(=C2)C(F)(F)F
InChI=1SC13H10F3NO3Sc12012(19)109(18)62111(10)1784237(58)13(1415)16h2517H6H21H3
BBL003918
Synonyms: ethyl2-{[(4-nitrophenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
ethyl2(((4nitrophenyl)sulfonyl)amino)4567tetrahydro1benzothiophene3carboxylate
63183277
MFCD00294955
ZINC000005967287
ZINC5967287
ethyl2((4nitrophenyl)sulfonylamino)4567tetrahydro1benzothiophene3carboxylate
CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H18N2O6S2c122517(20)1513534614(13)2616(15)1827(2324)129711(81012)19(21)22h71018H26H21H3
BBL003919
Synonyms: 3-[(E)-(hydroxyimino)methyl]benzene-1,2-diol
Smiles: O/N=C/c1cccc(c1O)O
ON=Cc1cccc(c1O)O
3((E)(hydroxyimino)methyl)benzene12diol
110827844
BBL003920
Synonyms: ethyl4-methyl-2-(pyrrolidin-1-yl)pyrimidine-5-carboxylate
Smiles: CCOC(=O)c1cnc(nc1C)N1CCCC1
CCOC(=O)c1cnc(nc1C)N1CCCC1
ETHYL4METHYL2(PYRROLIDIN1YL)PYRIMIDINE5CARBOXYLATE
5PYRIMIDINECARBOXYLICACID4METHYL2(1PYRROLIDINYL)ETHYLESTER
637003395
ETHYL4METHYL2PYRROLIDINYLPYRIMIDINE5CARBOXYLATE
MFCD08131932
ZINC000014607445
ZINC14607445
ethyl4methyl2pyrrolidin1ylpyrimidine5carboxylate
CCOC(=O)C1=CN=C(N=C1C)N2CCCC2
InChI=1SC12H17N3O2c131711(16)1081312(149(10)2)15645715h8H37H212H3
BBL003921
Synonyms: 2-chloro-1-(2-methyl-1H-indol-3-yl)-2-phenylethanone
Smiles: ClC(C(=O)c1c(C)[nH]c2c1cccc2)c1ccccc1
ClC(C(=O)c1c(C)(nH)c2c1cccc2)c1ccccc1
2CHLORO1(2METHYL1HINDOL3YL)2PHENYLETHANONE
2CHLORO1(2METHYLINDOL3YL)2PHENYLETHAN1ONE
57642010
MFCD08753433
ZINC000008731205
ZINC000008731206
CC1=C(C2=CC=CC=C2N1)C(=O)C(C3=CC=CC=C3)Cl
InChI=1SC17H14ClNOc11115(139561014(13)1911)17(20)16(18)127324812h2101619H1H3
BBL003922
Synonyms: 5-(3,5-difluorophenyl)cyclohexane-1,3-dione
Smiles: O=C1CC(CC(=O)C1)c1cc(F)cc(c1)F
O=C1CC(CC(=O)C1)c1cc(F)cc(c1)F
ZINC100014306
5(35DIFLUOROPHENYL)CYCLOHEXANE13DIONE
928710558
C1C(CC(=O)CC1=O)C2=CC(=CC(=C2)F)F
InChI=1SC12H10F2O2c13917(210(14)59)8311(15)612(16)48h1258H346H2
BBL003923
Synonyms: N-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)morpholine-4-carboximidamide
Smiles: N=C(N1CCOCC1)Nc1nc(C)cc(=O)[nH]1
N=C(N1CCOCC1)Nc1nc(C)cc(=O)(nH)1
ZINC000019626644
ZINC19626644
2((IMINOMORPHOLIN4YLMETHYL)AMINO)6METHYL3HYDROPYRIMIDIN4ONE
2(MORPHOLINO(IMINO)METHYLAMINO)6METHYL34DIHYDROPYRIMIDINE4ONE
55474801
MFCD08575988
N(4HYDROXY6METHYLPYRIMIDIN2YL)MORPHOLINE4CARBOXIMIDAMIDE
N(4METHYL6OXO16DIHYDROPYRIMIDIN2YL)MORPHOLINE4CARBOXIMIDAMIDE
N(6methyl4oxo1Hpyrimidin2yl)morpholine4carboximidamide
CC1=CC(=O)N=C(N1)N=C(N)N2CCOCC2
InChI=1SC10H15N5O2c1768(16)1310(127)149(11)1524175315h6H25H21H3(H31112131416)
BBL003924
Synonyms: 6-amino-2-(3-methylpiperidin-1-yl)pyrimidin-4(3H)-one
Smiles: CC1CCCN(C1)c1nc(N)cc(=O)[nH]1
CC1CCCN(C1)c1nc(N)cc(=O)(nH)1
1020243951
6AMINO2(3METHYLPIPERIDIN1YL)3HPYRIMIDIN4ONE
6AMINO2(3METHYLPIPERIDIN1YL)PYRIMIDIN4(3H)ONE
6AMINO2(3METHYLPIPERIDYL)3HYDROPYRIMIDIN4ONE
6amino2(3methylpiperidin1yl)1Hpyrimidin4one
CC1CCCN(C1)C2=NC(=O)C=C(N2)N
InChI=1SC10H16N4Oc1732414(67)10128(11)59(15)1310h57H246H21H3(H311121315)
BBL003925
Synonyms: 6-amino-2-(4-methylpiperidin-1-yl)pyrimidin-4(3H)-one
Smiles: CC1CCN(CC1)c1nc(N)cc(=O)[nH]1
CC1CCN(CC1)c1nc(N)cc(=O)(nH)1
MFCD09880803
ZINC000015109426
ZINC15109426
1020243940
6AMINO2(4METHYLPIPERIDIN1YL)3HPYRIMIDIN4ONE
6AMINO2(4METHYLPIPERIDIN1YL)PYRIMIDIN4(3H)ONE
6AMINO2(4METHYLPIPERIDYL)3HYDROPYRIMIDIN4ONE
6amino2(4methylpiperidin1yl)1Hpyrimidin4one
CC1CCN(CC1)C2=NC(=O)C=C(N2)N
InChI=1SC10H16N4Oc172414(537)10128(11)69(15)1310h67H25H21H3(H311121315)
BBL003926
Synonyms: (2E)-2-cyano-3-[5-(2,4,6-trichlorophenyl)furan-2-yl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1c(Cl)cc(cc1Cl)Cl)/C(=O)N
N#CC(=Cc1ccc(o1)c1c(Cl)cc(cc1Cl)Cl)C(=O)N
ZINC000002505853
ZINC02505853
ZINC2505853
(2E)2CYANO3(5(246TRICHLOROPHENYL)FURAN2YL)PROP2ENAMIDE
(E)2CYANO3(5(246TRICHLOROPHENYL)FURAN2YL)PROP2ENAMIDE
299936417
MFCD03030043
C1=C(OC(=C1)C2=C(C=C(C=C2Cl)Cl)Cl)C=C(C#N)C(=O)N
InChI=1SC14H7Cl3N2O2c158410(16)13(11(17)58)12219(2112)37(618)14(19)20h15H(H21920)b73+
BBL003927
Synonyms: methyl(2-oxo-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-3-yl)acetate
Smiles: COC(=O)CC1Cn2c(NC1=O)nc1c2cccc1
COC(=O)CC1Cn2c(NC1=O)nc1c2cccc1
methyl(2oxo1234tetrahydropyrimido(12a)benzimidazol3yl)acetate
MFCD11082690
ZINC000019957408
ZINC000019957413
1030553684
METHYL(2HYDROXY34DIHYDROPYRIMIDO(12A)BENZIMIDAZOL3YL)ACETATE
methyl2(2oxo410dihydro3Hpyrimido(12a)benzimidazol3yl)acetate
COC(=O)CC1CN2C3=CC=CC=C3NC2=NC1=O
InChI=1SC13H13N3O3c11911(17)687161053249(10)1413(16)1512(8)18h258H67H21H3(H141518)
BBL003928
Synonyms: (6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)cyanamide
Smiles: N#CNc1nc(cc(=O)[nH]1)c1ccccc1
N#CNc1nc(cc(=O)(nH)1)c1ccccc1
ZINC16857703
(6OXO4PHENYL16DIHYDROPYRIMIDIN2YL)CYANAMIDE
6112681
AMINO(4OXO6PHENYL(3HYDROPYRIMIDIN2YL))CARBONITRILE
(4oxo6phenyl1Hpyrimidin2yl)cyanamide
C1=CC=C(C=C1)C2=CC(=O)N=C(N2)NC#N
InChI=1SC11H8N4Oc1271311149(610(16)1511)8421358h16H(H213141516)
BBL003929
Synonyms: methyl[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1n[nH]c(n1)N
COC(=O)CSc1n(nH)c(n1)N
444791451
METHYL((5AMINO1H124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2((5AMINO1H124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2((5AMINO4H124TRIAZOL3YL)THIO)ACETATE
METHYL2(5AMINO1H124TRIAZOL3YLTHIO)ACETATE
METHYL2(5AMINO4H124TRIAZOL3YLTHIO)ACETATE
ZINC05577500
ZINC5577500
COC(=O)CSC1=NNC(=N1)N
InChI=1SC5H8N4O2Sc1113(10)212574(6)895h2H21H3(H36789)
BBL003930
Synonyms: methyl(2E)-2-cyano-3-[5-(2,4,6-trichlorophenyl)furan-2-yl]prop-2-enoate
Smiles: COC(=O)/C(=C/c1ccc(o1)c1c(Cl)cc(cc1Cl)Cl)/C#N
COC(=O)C(=Cc1ccc(o1)c1c(Cl)cc(cc1Cl)Cl)C#N
METHYL(E)2CYANO3(5(246TRICHLOROPHENYL)FURAN2YL)PROP2ENOATE
400739824
METHYL(2E)2CYANO3(5(246TRICHLOROPHENYL)FURAN2YL)PROP2ENOATE
MFCD03030034
ZINC000002505845
ZINC02505845
ZINC2505845
COC(=O)C(=CC1=CC=C(O1)C2=C(C=C(C=C2Cl)Cl)Cl)C#N
InChI=1SC15H8Cl3NO3c12115(20)8(719)4102313(2210)1411(17)59(16)612(14)18h26H1H3b84+
BBL003931
Synonyms: N-tert-butyl-3-oxobutanamide
Smiles: O=C(NC(C)(C)C)CC(=O)C
O=C(NC(C)(C)C)CC(=O)C
ZINC00563918
ZINC563918
42222060
ACETOACETAMIDENTERTBUTYL
N(11DIMETHYLETHYL)3OXOBUTANAMIDE
N(TERTBUTYL)3OXOBUTANAMIDE
NTBUTYL3KETOBUTANAMIDE
NTERTBUTYL3OXOBUTANAMIDE
NTERTBUTYLACETOACETAMIDE
NTERTBUTYLACETOACETAMIDE99
CC(=O)CC(=O)NC(C)(C)C
InChI=1SC8H15NO2c16(10)57(11)98(23)4h5H214H3(H911)
BBL003932
Synonyms: [1-(2-chlorophenyl)-3-oxo-3-(thiophen-2-yl)propyl]propanedinitrile
Smiles: N#CC(C(c1ccccc1Cl)CC(=O)c1cccs1)C#N
N#CC(C(c1ccccc1Cl)CC(=O)c1cccs1)C#N
ZINC000001262456
ZINC000001262457
MFCD00716208
((1R)1(2CHLOROPHENYL)3OXO3(THIOPHEN2YL)PROPYL)PROPANEDINITRILE
(1(2CHLOROPHENYL)3OXO3(THIOPHEN2YL)PROPYL)PROPANEDINITRILE
2(1(2CHLOROPHENYL)3OXO3THIOPHEN2YLPROPYL)MALONONITRILE
2(1(2CHLOROPHENYL)3OXO3THIOPHEN2YLPROPYL)PROPANEDINITRILE
82137584
C1=CC=C(C(=C1)C(CC(=O)C2=CC=CS2)C(C#N)C#N)Cl
InChI=1SC16H11ClN2OSc1714521412(14)13(11(918)1019)815(20)166372116h171113H8H2
BBL003933
Synonyms: [1-(2,4-dichlorophenyl)-3-oxo-3-(thiophen-2-yl)propyl]propanedinitrile
Smiles: N#CC(C(c1ccc(cc1Cl)Cl)CC(=O)c1cccs1)C#N
N#CC(C(c1ccc(cc1Cl)Cl)CC(=O)c1cccs1)C#N
ZINC000002568480
ZINC000004499423
MFCD00716250
(1(24DICHLOROPHENYL)3OXO3(THIOPHEN2YL)PROPYL)PROPANEDINITRILE
2(1(24DICHLOROPHENYL)3OXO3THIOPHEN2YLPROPYL)MALONONITRILE
2(1(24DICHLOROPHENYL)3OXO3THIOPHEN2YLPROPYL)PROPANEDINITRILE
400737442
C1=CSC(=C1)C(=O)CC(C2=C(C=C(C=C2)Cl)Cl)C(C#N)C#N
InChI=1SC16H10Cl2N2OSc17113412(14(18)611)13(10(819)920)715(21)162152216h161013H7H2
BBL003934
Synonyms: 5-phenyl-2-{[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methylidene}cyclohexane-1,3-dione
Smiles: O=C1CC(CC(=O)/C/1=C\NC1CC(C)(C)NC(C1)(C)C)c1ccccc1
O=C1CC(CC(=O)C1=CNC1CC(C)(C)NC(C1)(C)C)c1ccccc1
5phenyl2(((2266tetramethylpiperidin4yl)amino)methylidene)cyclohexane13dione
350713983
BBL003935
Synonyms: 11-(4-hydroxy-3-methoxyphenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1cc(ccc1O)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
COc1cc(ccc1O)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
11(4hydroxy3methoxyphenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
297160475
2benzoyl6(4hydroxy3methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)NC4=C(N2)C=CC(=C4)C(=O)C5=CC=CC=C5)O
InChI=1SC27H24N2O4c133241517(111322(24)30)262520(85923(25)31)28211418(101219(21)2926)27(32)166324716h24671015262830H589H21H3
BBL003936
Synonyms: 4,5,6-trichloro-1,3-benzoxazol-2(3H)-one
Smiles: O=c1[nH]c2c(o1)cc(c(c2Cl)Cl)Cl
O=c1(nH)c2c(o1)cc(c(c2Cl)Cl)Cl
ZINC000000271036
ZINC271036
MFCD00460200
2(3H)BENZOXAZOLONE456TRICHLORO
456TRICHLORO13BENZOXAZOL2(3H)ONE
456TRICHLORO2(3H)BENZOXAZOLINONE
456TRICHLORO2(3H)BENZOXAZOLONE
456TRICHLORO2BENZOXAZOLINONE
456TRICHLORO3H13BENZOXAZOL2ONE
456TRICHLORO3HYDROBENZOXAZOL2ONE
456TRICHLOROBENZOXAZOLINONE
50995943
C1=C2C(=C(C(=C1Cl)Cl)Cl)NC(=O)O2
InChI=1SC7H2Cl3NO2c82136(5(10)4(2)9)117(12)133h1H(H1112)
BBL003937
Synonyms: 7,8,9,10-tetrahydrophenanthridine
Smiles: C1CCc2c(C1)c1ccccc1nc2
C1CCc2c(C1)c1ccccc1nc2
78910tetrahydrophenanthridine
MFCD00848896
ZINC000004015346
ZINC04015346
ZINC4015346
62833925
C1CCC2=C(C1)C=NC3=CC=CC=C23
InChI=1SC13H13Nc1261110(51)91413843712(11)13h3479H1256H2
BBL003938
Synonyms: 1-ethyl-2,3,3-trimethyl-3H-indolium
Smiles: CC[N+]1=C(C)C(c2c1cccc2)(C)C
CC(N+)1=C(C)C(c2c1cccc2)(C)C
ZINC03131100
ZINC3131100
1ETHYL233TRIMETHYL3HINDOLE1IUM
1ETHYL233TRIMETHYL3HINDOLE3IUM
1ETHYL233TRIMETHYL3HINDOLIUM
1ETHYL233TRIMETHYLINDOL1IUM
CC(N+)1=C(C(C2=CC=CC=C21)(C)C)C
InChI=1SC13H18Nc151410(2)13(34)11867912(11)14h69H5H214H3q+1
BBL003939
Synonyms: 3-ethyl-2-[(E)-2-(phenylamino)ethenyl]-4,5-dihydro-1,3-thiazol-3-ium
Smiles: CC[N+]1=C(SCC1)/C=C/Nc1ccccc1
CC(N+)1=C(SCC1)C=CNc1ccccc1
3ETHYL2((E)2(PHENYLAMINO)ETHENYL)45DIHYDRO13THIAZOL3IUM
3ETHYL2(2PHENYLAMINOVINYL)45DIHYDROTHIAZOL3IUM
3ETHYL45DIHYDRO2(2(PHENYLAMINO)ETHENYL)THIAZOL3IUM
N((E)2(3ETHYL45DIHYDRO13THIAZOL3IUM2YL)ETHENYL)ANILINE
N(2(3ETHYL45DIHYDRO13THIAZOL3IUM2YL)ETHENYL)ANILINE
ZINC00289584
ZINC289584
N((Z)2(3ethyl45dihydro13thiazol3ium2yl)ethenyl)aniline
CC(N+)1=C(SCC1)C=CNC2=CC=CC=C2
InChI=1SC13H16N2Sc121510111613(15)8914126435712h39H21011H21H3p+1
BBL003940
Synonyms: N-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-N-phenylacetamide
Smiles: C=CCN1C(=S)S/C(=C\N(c2ccccc2)C(=O)C)/C1=O
C=CCN1C(=S)SC(=CN(c2ccccc2)C(=O)C)C1=O
N((Z)(4OXO3(PROP2EN1YL)2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)NPHENYLACETAMIDE
N((Z)(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)NPHENYLACETAMIDE
ZINC16101883
1321698296
CC(=O)N(C=C1C(=O)N(C(=S)S1)CC=C)C2=CC=CC=C2
InChI=1SC15H14N2O2S2c1391614(19)13(2115(16)20)1017(11(2)18)127546812h3810H19H22H3b1310
BBL003941
Synonyms: N-(1H-benzotriazol-1-ylmethyl)aniline
Smiles: c1ccc(cc1)NCn1nnc2c1cccc2
c1ccc(cc1)NCn1nnc2c1cccc2
(BENZOTRIAZOLYLMETHYL)PHENYLAMINE
1((PHENYLAMINO)METHYL)BENZOTRIAZOLE
1HBENZOTRIAZOLE1METHANAMINENPHENYL
62001290
N(1H123BENZOTRIAZOL1YLMETHYL)ANILINE
N(1HBENZOTRIAZOL1YLMETHYL)ANILINE
N(BENZOTRIAZOL1YLMETHYL)ANILINE
NPHENYL1HBENZOTRIAZOLE1METHANAMINE
NPHENYLBENZOTRIAZOLEMETHANAMINEMIXTUREOFBT1ANDBT2ISOMERS
ZINC03877930
ZINC3877930
C1=CC=C(C=C1)NCN2C3=CC=CC=C3N=N2
InChI=1SC13H12N4c12611(731)14101713954812(13)151617h1914H10H2
BBL003942
Synonyms: 3-ethyl-2-methyl-1,3-benzothiazol-3-ium
Smiles: CC[n+]1c(C)sc2c1cccc2
CC(n+)1c(C)sc2c1cccc2
ZINC00087588
ZINC87588
3ETHYL2METHYL13BENZOTHIAZOL3IUM
3ETHYL2METHYLBENZOTHIAZOL3IUM
3ETHYL2METHYLBENZOTHIAZOLE
42846151
BENZOTHIAZOLIUM3ETHYL2METHYL
CC(N+)1=C(SC2=CC=CC=C21)C
InChI=1SC10H12NSc13118(2)121075469(10)11h47H3H212H3q+1
BBL003943
Synonyms: 1,5-diphenylpyrazolidin-3-one
Smiles: O=C1CC(N(N1)c1ccccc1)c1ccccc1
O=C1CC(N(N1)c1ccccc1)c1ccccc1
15DIPHENYL3PYRAZOLIDINONE
15DIPHENYLPYRAZOLIDIN3ONE
15DIPHENYLPYRAZOLIDINE3ONE
1PHENYL5PHENYLPYRAZOLIDIN3ONE
3PYRAZOLIDINONE15DIPHENYL
6118952
C1C(N(NC1=O)C2=CC=CC=C2)C3=CC=CC=C3
InChI=1SC15H14N2Oc18151114(127314812)17(1615)1395261013h11014H11H2(H1618)
BBL003944
Synonyms: (5E)-3-ethyl-5-[(2E,4E)-5-(phenylamino)penta-2,4-dien-1-ylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN1C(=S)S/C(=C/C=C/C=C/Nc2ccccc2)/C1=O
CCN1C(=S)SC(=CC=CC=CNc2ccccc2)C1=O
ZINC12411872
(5E)3ETHYL5((2E4E)5(PHENYLAMINO)PENTA24DIEN1YLIDENE)2THIOXO13THIAZOLIDIN4ONE
(5E)5((2E4E)5ANILINOPENTA24DIENYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
3ETHYL5(5PHENYLAMINOPENTA24DIENYLIDENE)2THIOXOTHIAZOLIDIN4ONE
CCN1C(=O)C(=CC=CC=CNC2=CC=CC=C2)SC1=S
InChI=1SC16H16N2OS2c121815(19)14(2116(18)20)1174812171395361013h31217H2H21H3b74+128+1411+
BBL003945
Synonyms: S-{[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)sulfanyl]methyl}O,O-diethylphosphorodithioate
Smiles: CCOP(=S)(SCSn1c(=O)oc2c1ccc(c2)Cl)OCC
CCOP(=S)(SCSn1c(=O)oc2c1ccc(c2)Cl)OCC
328084613
6CHLORO3(DIETHOXYPHOSPHINOTHIOYLSULFANYLMETHYLSULFANYL)13BENZOXAZOL2ONE
MFCD01931254
S(((6CHLORO2OXO13BENZOXAZOL3(2H)YL)SULFANYL)METHYL)OODIETHYLPHOSPHORODITHIOATE
ZINC02766350
ZINC2766350
CCOP(=S)(OCC)SCSN1C2=C(C=C(C=C2)Cl)OC1=O
InChI=1SC12H15ClNO4PS3c131619(201742)228211410659(13)711(10)1812(14)15h57H348H212H3
BBL003946
Synonyms: iodoaceticacid
Smiles: OC(=O)CI
OC(=O)CI
ZINC3860524
2IODOACETICACID
64697
ACETICACID2IODO
ACETICACIDIODO
ACETICACIDIODO(8CI9CI)
IODOACETATE
IODOACETICACID
IODOACETICACID113C
IODOETHANOICACID
MONOIODINEACETATE
MONOIODOACETATE
MONOIODOACETICACID
C(C(=O)O)I
InChI=1SC2H3IO2c312(4)5h1H2(H45)
BBL003947
Synonyms: 3-methylpyridin-2-amine
Smiles: Cc1cccnc1N
Cc1cccnc1N
PYRIDINE2AMINO3METHYL
ZINC402702
2AMINO3METHYLPYRIDINE
2AMINO3METHYLPYRIDINE(2AMINO3PICOLINE)
2AMINO3PICOLINE
(3METHYLPYRIDIN2YL)AMINE
1603403
2AMINOBETAPICOLINE
2AMINOMETHYLPYRIDINE
2AMINOPICOLINEAMINO3METHYLPYRIDINE
2PYRIDINAMINE3METHYL
3METHYL2AMINOPYRIDINE
3METHYL2PYRIDINAMINE
3METHYL2PYRIDINEAMINE
3METHYL2PYRIDYLAMINE
3METHYLAMINOPYRIDINE
3METHYLPYRIDIN2(1H)IMINE
3METHYLPYRIDIN2AMINE
3METHYLPYRIDIN2YLAMINE
3METHYLPYRIDINE2AMINE
3PICOLINE2AMINO
3PICOLINE2AMINO(8CI)
CC1=C(N=CC=C1)N
InChI=1SC6H8N2c1532486(5)7h24H1H3(H278)
BBL003948
Synonyms: 1,3,4-thiadiazol-2-amine
Smiles: Nc1nncs1
Nc1nncs1
ZINC17744119
(134)THIADIAZOL2YLAMINE
134THIADIAZOL2AMINE
134THIADIAZOL2YLAMINE
134THIADIAZOL5AMINE
134THIADIAZOLE2AMINE
134THIADIAZOLE2AMINO
134THIADIAZOLE2YLAMINE
14THIADIAZOL2AMINE
14THIADIAZOLE2AMINO
2AMINO(134)THIADIAZOLE
2AMINO134THIADIAZOL
2AMINO134THIADIAZOLE
2AMINO14THIADIAZOLE
2AMINO1THIA34DIAZOLE
2AMINOTHIADIAZOLE
3H134THIADIAZOL2IMINE
4005510
AMINOTHIADAZOLE
AMINOTHIADIAZOLE
C1=NN=C(S1)N
InChI=1SC2H3N3Sc3254162h1H(H235)
BBL003949
Synonyms: 4-(4-nitrobenzyl)pyridine
Smiles: [O-][N+](=O)c1ccc(cc1)Cc1ccncc1
(O)(N+)(=O)c1ccc(cc1)Cc1ccncc1
1(PNITROBENZYL)PYRIDINE
1083483
4((4NITROPHENYL)METHYL)PYRIDINE
4(4NITROBENZYL)PRIMIDE
4(4NITROBENZYL)PYRIDIN
4(4NITROBENZYL)PYRIDINE
4(PNITROBENZYL)PYRIDINE
PYRIDINE4((4NITROPHENYL)METHYL)
PYRIDINE4(PNITROBENZYL)
ZINC02567872
ZINC2567872
GAMMA(4NITROBENZYL)PYRIDINE
GAMMA(PNITROBENZYL)PYRIDINE
C1=CC(=CC=C1CC2=CC=NC=C2)(N+)(=O)(O)
InChI=1SC12H10N2O2c1514(16)123110(2412)91157138611h18H9H2
BBL003950
Synonyms: 2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
Smiles: OC(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)N
OC(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)N
2(4aminophenyl)111333hexafluoropropan2ol
2(4AMINOPHENYL)HEXAFLUORO2PROPANOL
4(1HYDROXY1TRIFLUOROMETHYL222TRIFLUOROETHYL)ANILINE
4(HEXAFLUORO2HYDROXY2PROPYL)ANILINE
4(HEXAFLUORO2HYDROXYISOPROPYL)ANILINE
4AMINOAABIS(TRIFLUOROMETHYL)BENZYLALCOHOL4(HEXAFLUORO2HYDROXYISOPROPYL)ANILINE
722929
BENZENEMETHANOL4AMINOAABIS(TRIFLUOROMETHYL)
ZINC000000056254
ZINC00056254
ZINC56254
MFCD00039258
C1=CC(=CC=C1C(C(F)(F)F)(C(F)(F)F)O)N
InChI=1SC9H7F6NOc108(1112)7(179(1314)15)5136(16)425h1417H16H2
BBL003951
Synonyms: 4-(difluoromethoxy)benzaldehyde
Smiles: O=Cc1ccc(cc1)OC(F)F
O=Cc1ccc(cc1)OC(F)F
P(DIFLUOROMETHOXY)BENZALDEHYDE
PDIFLUOROMETHOXYBENZALDEHYDE
ZINC00167174
ZINC167174
1(DIFLUOROMETHOXY)4FORMYLBENZENE
4(DIFLUOROMETHOXY)BENZALDEHYDE
4DIFLUOROMETHOXYBENZALDEHYDE
73960073
BENZALDEHYDE4(DIFLUOROMETHOXY)
C1=CC(=CC=C1C=O)OC(F)F
InChI=1SC8H6F2O2c98(10)127316(511)247h158H
BBL003952
Synonyms: 5-chloro-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccc2c(c1)[nH]c(=O)o2
Clc1ccc2c(c1)(nH)c(=O)o2
CLORZOXAZONA
CLORZOXAZONE
2(3H)BENZOXAZOLONE5CHLORO
2BENZOXAZOLINONE5CHLORO
5CHLOROBENZOKSAZOLON2(POLISH)
5CHLOROBENZOOXAZOL2OL
5CHLOROBENZOXAZOL2ONE
5CHLOROBENZOXAZOLIDONE
5CHLOROBENZOXAZOLIN2ONE
5CHLOROBENZOXAZOLINONE
5CHLOROBENZOXAZOLONE
95250
CHLOROXAZONE
CHLORSOXAZONE
CHLORZOXANE
CHLORZOXAZON
CHLORZOXAZONA
CHLORZOXAZONE
CHLORZOXAZONE(INNBANJAN)
CHLORZOXAZONE(JANUSPINN)
CHLORZOXAZONE(USPINNBANJAN)
CHLORZOXAZONE213C315NHYDROXYL18O
CHLORZOXAZONUM
CHLORZOXAZONUM(INNLATIN)
CITREX(ACARICIDE)
KLORZOXAZON
MCNEILBRANDOFCHLORZOXAZONE
ORTHOBRANDOFCHLORZOXAZONE
RELAXAZONE
REMULAR
REMULARS
ZINC84843283
2HYDROXY5CHLOROBENZOXAZOLE
5CHLORANYL3H13BENZOXAZOL2ONE
5CHLORBENZOXAZOLIN2ON
5CHLORO13BENZOXAZOL2(3H)ONE
5CHLORO13BENZOXAZOL2OL
5CHLORO13BENZOXAZOLE2(3H)ONE
5CHLORO2(3H)BENZOXAZOLONE
5CHLORO2(3H)BENZOXAZOLONE5CHLORO2HYDROXYBENZOXAZOLE
5CHLORO23DIHYDRO13BENZOXAZOL2ONE
5CHLORO23DIHYDRO2OXO13BENZOXAZOLE
5CHLORO2BENZOXAZOLINONE
5CHLORO2BENZOXAZOLOL
5CHLORO2BENZOXAZOLONE
5CHLORO2HYDROXYBENZOXAZOLE
5CHLORO3(H)2BENZOXAZOLONE
5CHLORO3H13BENZOXAZOL2ONE
5CHLORO3HBENZOOXAZOL2ONE
5CHLORO3HBENZOXAZOL2ONE
5CHLORO3HYDROBENZOXAZOL2ONE
5CHLOROBENZO(D)OXAZOL2(3H)ONE
5CHLOROBENZO(D)OXAZOL2OL
5CHLOROBENZOKSAZOLINON2
5CHLOROBENZOKSAZOLINON2(POLISH)
5CHLOROBENZOKSAZOLON2
C1=CC2=C(C=C1Cl)NC(=O)O2
InChI=1SC7H4ClNO2c841265(34)97(10)116h13H(H910)
BBL003953
Synonyms: 4-(acetyloxy)-3-methoxybenzoicacid
Smiles: COc1cc(ccc1OC(=O)C)C(=O)O
COc1cc(ccc1OC(=O)C)C(=O)O
OACETYLVANILLICACID
ZINC185066
10543121
3METHOXY4ACETOXYBENZOICACID
4(ACETYLOXY)3METHOXYBENZOICACID
4ACETOXY3METHOXYBENZOICACID
4ACETOXYBENZOICACIDMETHYLETHER
4ACETOXYMETAANISICACID
4ACETYLOXY3METHOXYBENZOICACID
BENZOICACID4(ACETYLOXY)3METHOXY
CC(=O)OC1=C(C=C(C=C1)C(=O)O)OC
InChI=1SC10H10O5c16(11)158437(10(12)13)59(8)142h35H12H3(H1213)
BBL003954
Synonyms: 4-(methylsulfamoyl)benzoicacid
Smiles: CNS(=O)(=O)c1ccc(cc1)C(=O)O
CNS(=O)(=O)c1ccc(cc1)C(=O)O
P(METHYLSULFAMOYL)BENZOICACID
ZINC3597296
10252638
4((METHYLAMINO)SULFONYL)BENZOICACID
4(METHYLSULFAMOYL)BENZOICACID
4(NMETHYLSULFAMOYL)BENZOICACID
4METHYLAMINOSULFONYLBENZOICACID
4METHYLSULFAMOYLBENZOICACID
BENZOICACID4((METHYLAMINO)SULFONYL)
CNS(=O)(=O)C1=CC=C(C=C1)C(=O)O
InChI=1SC8H9NO4Sc1914(1213)7426(357)8(10)11h259H1H3(H1011)
BBL003955
Synonyms: 2-(5-phenyl-1,3-oxazol-2-yl)benzoicacid
Smiles: OC(=O)c1ccccc1c1ncc(o1)c1ccccc1
OC(=O)c1ccccc1c1ncc(o1)c1ccccc1
ZINC301121
2(5PHENYL13OXAZOL2YL)BENZOICACID
2(5PHENYL2OXAZOLYL)BENZOICACID
23464973
BENZOICACID2(5PHENYL2OXAZOLYL)
C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC=C3C(=O)O
InChI=1SC16H11NO3c1816(19)13954812(13)15171014(2015)116213711h110H(H1819)
BBL003956
Synonyms: ethyl[(4-methylphenyl)amino](oxo)acetate
Smiles: CCOC(=O)C(=O)Nc1ccc(cc1)C
CCOC(=O)C(=O)Nc1ccc(cc1)C
ETHYL((4METHYLPHENYL)AMINO)(OXO)ACETATE
ETHYL((4METHYLPHENYL)CARBAMOYL)FORMATE
ETHYL(N(4METHYLPHENYL)CARBAMOYL)FORMATE
ETHYL0((4METHYLPHENYL)CARBAMOYL)FORMATE
ETHYL2(4METHYLANILINO)2OXOACETATE
ETHYL2OXO2(4TOLUIDINO)ACETATE
ETHYL2OXO2(PTOLYLAMINO)ACETATE
ETHYL4METHYLOXANILATE
MFCD00065285
OXANILICACID4METHYLETHYLESTER
ZINC000002169897
ZINC02169897
ZINC2169897
18522980
CCOC(=O)C(=O)NC1=CC=C(C=C1)C
InChI=1SC11H13NO3c131511(14)10(13)129648(2)579h47H3H212H3(H1213)
BBL003957
Synonyms: 2-amino-N-(4-methylbenzyl)benzamide
Smiles: Cc1ccc(cc1)CNC(=O)c1ccccc1N
Cc1ccc(cc1)CNC(=O)c1ccccc1N
2AMINON((4METHYLPHENYL)METHYL)BENZAMIDE
554423040
MFCD03978466
ZINC000003316254
ZINC03316254
ZINC3316254
2AMINON(4METHYLBENZYL)BENZAMIDE
CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2N
InChI=1SC15H16N2Oc1116812(9711)101715(18)13423514(13)16h29H1016H21H3(H1718)
BBL003958
Synonyms: N-(2-hydroxyethyl)-N'-(4-methylphenyl)ethanediamide
Smiles: OCCNC(=O)C(=O)Nc1ccc(cc1)C
OCCNC(=O)C(=O)Nc1ccc(cc1)C
ZINC000002900071
ZINC02900071
ZINC2900071
357268383
MFCD00712860
N(2HYDROXYETHYL)N(4METHYLPHENYL)ETHANEDIAMIDE
N(2HYDROXYETHYL)N(4METHYLPHENYL)OXAMIDE
CC1=CC=C(C=C1)NC(=O)C(=O)NCCO
InChI=1SC11H14N2O3c18249(538)1311(16)10(15)126714h2514H67H21H3(H1215)(H1316)
BBL003959
Synonyms: pyrrolidin-1-ylacetonitrile
Smiles: N#CCN1CCCC1
N#CCN1CCCC1
NPYRROLIDINOACETONITRILE
PYRROLDINOACETONITRILE
PYRROLIDIN1YLACETONITRILE
PYRROLIDINE1ACETONITRILE
PYRROLIDINOACETONITRILE
ZINC19488582
(1PYRROLIDINO)ACETONITRILE
1CYANOMETHYLPYRROLIDINE
1PYRROLIDINEACETONITRILE
1PYRROLIDINYLACETONITRILE
2(PYRROLIDIN1YL)ACETONITRILE
29134290
2PYRROLIDIN1YLACETONITRILE
2PYRROLIDINYLETHANENITRILE
C1CCN(C1)CC#N
InChI=1SC6H10N2c736841258h1246H2
BBL003960
Synonyms: 1-amino-4-hydroxyanthracene-9,10-dione
Smiles: Oc1ccc(c2c1C(=O)c1ccccc1C2=O)N
Oc1ccc(c2c1C(=O)c1ccccc1C2=O)N
SUPRACETBRILLIANTRED2B
ZINC000003860170
ZINC03860170
ZINC3860170
1AMINO4HYDROXY910ANTHRAQUINONE
1AMINO4HYDROXY910DIHYDROANTHRACENE910DIONE
1AMINO4HYDROXYANTHRA910QUINONE
1AMINO4HYDROXYANTHRACENE910DIONE
1AMINO4HYDROXYANTHRAQUINONE
1AMINO4OXYANTHRAQUINONE
1HYDROXY4AMINOANTHRAQUINONE
4AMINO1HYDROXYANTHRAQUINONE
4HYDROXY1ANTHRAQUINONYLAMINE
910ANTHRACENEDIONE1AMINO4HYDROXY
91AMINO4HYDROXY
ACETATEFASTRED2B
ACETOQUINONELIGHTGOOSEBERRYRL
ACETYLONFASTPINKB
ANTHRAQUINONE1AMINO4HYDROXY
ARTISILDIRECTRED3BP
116858
1AMINO4HYDROXY910ANTHRACENEDIONE
DISPERSERED2S
DISPERSOLORANGEDG
FENACETFASTPINKB
CELANTHRENERED3BN
CERVENDISPERZNI15
CIDISPERSERED15
DISPERSEFASTPINKB
DISPERSERED15
DISPERSERED25
INTERCHEMACETATEPINKBLF
INTERCHEMHISPERSEPINKBH
MFCD00001223
C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)N
InChI=1SC14H9NO3c1595610(16)1211(9)13(17)731248(7)14(12)18h1616H15H2
BBL003961
Synonyms: 2-methyl-5-nitrobenzenesulfonamide
Smiles: [O-][N+](=O)c1ccc(c(c1)S(=O)(=O)N)C
(O)(N+)(=O)c1ccc(c(c1)S(=O)(=O)N)C
2METHYL5NITROBENZENE1SULFONAMIDE
2METHYL5NITROBENZENESULFONAMIDE
2METHYL5NITROBENZENESULPHONAMIDE
3AMINOSULFONYL4METHYLNITROBENZENE
4NITRO2TOLUENESULFONAMIDE
6269916
BENZENESULFONAMIDE2METHYL5NITRO
MFCD00115503
ZINC000003865903
ZINC03865903
ZINC3865903
CC1=C(C=C(C=C1)(N+)(=O)(O))S(=O)(=O)N
InChI=1SC7H8N2O4Sc15236(9(10)11)47(5)14(812)13h24H1H3(H281213)
BBL003962
Synonyms: 3-benzyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: O=C1CSC(=S)N1Cc1ccccc1
O=C1CSC(=S)N1Cc1ccccc1
RHODANINE3BENZYL
ZINC01041008
ZINC1041008
NBENZYLRHODANINE
10574693
3(PHENYLMETHYL)2THIOXO4THIAZOLIDINONE
3(PHENYLMETHYL)RHODANIDE
3BENZYL2SULFANYLIDENE13THIAZOLIDIN4ONE
3BENZYL2THIOXO13THIAZOLAN4ONE
3BENZYL2THIOXO13THIAZOLIDIN4ONE
3BENZYL2THIOXO4THIAZOLIDINONE
3BENZYL2THIOXOTHIAZOLIDIN4ONE
3BENZYL2THIOXOTHIAZOLIDINE4ONE
3BENZYLRHODANINE
4THIAZOLIDINONE3(PHENYLMETHYL)2THIOXO
4THIAZOLIDINONE3(PHENYLMETHYL)2THIOXO(9CI)
BENZYLRHODANINE
BENZYLTHIOXOTHIAZOLANONE
C1C(=O)N(C(=S)S1)CC2=CC=CC=C2
InChI=1SC10H9NOS2c12971410(13)11(9)68421358h15H67H2
BBL003963
Synonyms: (4-nitrobenzylidene)propanedinitrile
Smiles: N#CC(=Cc1ccc(cc1)[N+](=O)[O-])C#N
N#CC(=Cc1ccc(cc1)(N+)(=O)(O))C#N
NITROBENZENE4(22DICYANOETHENYL)
NITROPHENYLMETHYLENEMALONONITRILE
PNIROBENZYLIDENEMALONONITRILE
PNITROBENZALMALONITRILE
DICYANOPNITROSTYRENE
MALONONITRILE(PNITROBENZYLIDENE)
((4NITROPHENYL)METHYLENE)METHANE11DICARBONITRILE
(4NITROBENZYLIDENE)MALONONITRILE
PROPANEDINITRILE((4NITROPHENYL)METHYLENE)
PROPANEDINITRILE2((4NITROPHENYL)METHYLENE)
ZINC00097513
ZINC97513
(4NITROBENZYLIDENE)PROPANEDINITRILE
11DICYANO2(PNITROPHENYL)ETHENE
11DICYANO2ETHENE
2((4NITROPHENYL)METHYLENE)MALONONITRILE
2((4NITROPHENYL)METHYLENE)PROPANEDINITRILE
2((4NITROPHENYL)METHYLIDENE)PROPANEDINITRILE
2(4(HYDROXY(OXIDO)AMINO)BENZYLIDENE)MALONONITRILE
2(4NITROBENZYLIDENE)MALONONITRILE
2700234
2CYANO3(PNITROPHENYL)ACRYLONITRILE
4(22DICYANOETHENYL)NITROBENZENE
4NITRO11DICYANOSTYRENE
4NITROBENZYLIDENEMALONONITRILE
BETABETADICYANOPNITROSTYRENE
C1=CC(=CC=C1C=C(C#N)C#N)(N+)(=O)(O)
InChI=1SC10H5N3O2c1169(712)581310(428)13(14)15h15H
BBL003964
Synonyms: 6-bromo-1H-indole-2,3-dione
Smiles: Brc1ccc2c(c1)NC(=O)C2=O
Brc1ccc2c(c1)NC(=O)C2=O
6326790
6BROMO1HBENZO(D)AZOLIDINE23DIONE
6BROMO1HINDOLE23DIONE
6BROMO23INDOLINEDIONE
ZINC01661289
ZINC1661289
1HINDOLE23DIONE6BROMO
6BROMOINDOLE23DIONE
6BROMOINDOLIN23DIONE
6BROMOINDOLINE23DIONE
6BROMOISATIN
C1=CC2=C(C=C1Br)NC(=O)C2=O
InChI=1SC8H4BrNO2c941256(34)108(12)7(5)11h13H(H101112)
BBL003965
Synonyms: ethyl(3-methyl-1H-pyrazol-1-yl)acetate
Smiles: CCOC(=O)Cn1ccc(n1)C
CCOC(=O)Cn1ccc(n1)C
ETHYL(3METHYL1HPYRAZOL1YL)ACETATE
ETHYL2(3METHYL1HPYRAZOL1YL)ACETATE
ETHYL2(3METHYLPYRAZOL1YL)ACETATE
ETHYL2(3METHYLPYRAZOLYL)ACETATE
MFCD00462653
ZINC000002565682
ZINC02565682
ZINC2565682
(3METHYLPYRAZOL1YL)ACETICACIDETHYLESTER
934172619
CCOC(=O)CN1C=CC(=N1)C
InChI=1SC8H12N2O2c13128(11)610547(2)910h45H36H212H3
BBL003966
Synonyms: 4-(4-tert-butylphenyl)-4-oxobutanoicacid
Smiles: O=C(c1ccc(cc1)C(C)(C)C)CCC(=O)O
O=C(c1ccc(cc1)C(C)(C)C)CCC(=O)O
ZINC000002579954
ZINC2579954
MFCD02260961
3(4TERTBUTYLBENZOYL)PROPIONICACID
35288085
4(4(TERTBUTYL)PHENYL)4OXOBUTANOICACID
4(4TBUTYLPHENYL)4OXOBUTYRICACID
4(4TERTBUTYLPHENYL)4OXIDANYLIDENEBUTANOICACID
4(4TERTBUTYLPHENYL)4OXOBUTANOICACID
4(4TERTBUTYLPHENYL)4OXOBUTYRICACID
BENZENEBUTANOICACID4(11DIMETHYLETHYL)GOXO
CC(C)(C)C1=CC=C(C=C1)C(=O)CCC(=O)O
InChI=1SC14H18O3c114(23)116410(5711)12(15)8913(16)17h47H89H213H3(H1617)
BBL003967
Synonyms: (2E)-1-(4-aminophenyl)-3-phenylprop-2-en-1-one
Smiles: Nc1ccc(cc1)C(=O)/C=C/c1ccccc1
Nc1ccc(cc1)C(=O)C=Cc1ccccc1
ZINC04353000
ZINC4353000
(2E)1(4AMINOPHENYL)3PHENYL2PROPEN1ONE
(2E)1(4AMINOPHENYL)3PHENYLPROP2EN1ONE
(E)1(4AMINOPHENYL)3PHENYL2PROPENE1ONE
(E)1(4AMINOPHENYL)3PHENYLPROP2EN1ONE
2403307
2PROPEN1ONE1(4AMINOPHENYL)3PHENYL
4AMINOCHALCONE
C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)N
InChI=1SC15H13NOc16149713(81014)15(17)116124213512h111H16H2b116+
BBL003968
Synonyms: 3-(methylsulfonyl)-1H-1,2,4-triazole
Smiles: CS(=O)(=O)c1n[nH]cn1
CS(=O)(=O)c1n(nH)cn1
ZINC6928586
3(METHYLSULFONYL)1H124TRIAZOLE
3589057
3METHANESULFONYL1H(124)TRIAZOLE
3METHANESULFONYL4H124TRIAZOLE
3METHYLSULPHONYL124TRIAZOLE
5METHYLSULFONYL1H124TRIAZOLE
CS(=O)(=O)C1=NC=NN1
InChI=1SC3H5N3O2Sc19(78)342563h2H1H3(H456)
BBL003969
Synonyms: 4-methyl-5-phenyl-1,3-thiazol-2-amine
Smiles: Nc1nc(c(s1)c1ccccc1)C
Nc1nc(c(s1)c1ccccc1)C
ZINC08615662
ZINC8615662
28241625
2THIAZOLAMINE4METHYL5PHENYL
4METHYL5PHENYL13THIAZOL2AMINE
4METHYL5PHENYL13THIAZOLE2YLAMINE
4METHYL5PHENYL2THIAZOLAMINE
4METHYL5PHENYLTHIAZOL2AMINE
4METHYL5PHENYLTHIAZOL2YLAMINE
CC1=C(SC(=N1)N)C2=CC=CC=C2
InChI=1SC10H10N2Sc179(1310(11)127)8532468h26H1H3(H21112)
BBL003970
Synonyms: 2-amino-4,5-dimethylfuran-3-carbonitrile
Smiles: N#Cc1c(N)oc(c1C)C
N#Cc1c(N)oc(c1C)C
ZINC02564793
ZINC2564793
FURANE3CARBONITRILE2AMINO45DIMETHYL
2AMINO3CYANO45DIMETHYLFURAN
2AMINO3CYANO45DIMETHYLFURANE
2AMINO45DIMETHYL3FURANCARBONITRILE
2AMINO45DIMETHYL3FURONITRILE
2AMINO45DIMETHYLFURAN3CARBONITRILE
2AZANYL45DIMETHYLFURAN3CARBONITRILE
3FURANCARBONITRILE2AMINO45DIMETHYL
3FURONITRILE2AMINO45DIMETHYL
5117884
CC1=C(OC(=C1C#N)N)C
InChI=1SC7H8N2Oc145(2)107(9)6(4)38h9H212H3
BBL003971
Synonyms: 4-methoxy-3-sulfamoylbenzoicacid
Smiles: COc1ccc(cc1S(=O)(=O)N)C(=O)O
COc1ccc(cc1S(=O)(=O)N)C(=O)O
ZINC3374987
4METHOXY3(AMINOSULFONYL)BENZOICACID
20532063
3(AMINOSULFONYL)4METHOXYBENZOICACID
4METHOXY3SULFAMOYLBENZOICACID
COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N
InChI=1SC8H9NO5Sc1146325(8(10)11)47(6)15(912)13h24H1H3(H1011)(H291213)
BBL003972
Synonyms: 3-(dimethylsulfamoyl)-4-methoxybenzoicacid
Smiles: COc1ccc(cc1S(=O)(=O)N(C)C)C(=O)O
COc1ccc(cc1S(=O)(=O)N(C)C)C(=O)O
ZINC3374975
3((DIMETHYLAMINO)SULFONYL)4METHOXYBENZOICACID
3(DIMETHYLSULFAMOYL)4METHOXYBENZOICACID
3DIMETHYLSULFAMOYL4METHOXYBENZOICACID
786728890
CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC
InChI=1SC10H13NO5Sc111(2)17(1415)967(10(12)13)458(9)163h46H13H3(H1213)
BBL003973
Synonyms: methyl4,5-bis(chloromethyl)thiophene-2-carboxylate
Smiles: COC(=O)c1cc(c(s1)CCl)CCl
COC(=O)c1cc(c(s1)CCl)CCl
45BIS(CHLOROMETHYL)2THIOPHENECARBOXYLICACIDMETHYLESTER
45BIS(CHLOROMETHYL)THIOPHENE2CARBOXYLICACIDMETHYLESTER
45BISCHLOROMETHYLTHIOPHENE2CARBOXYLICACIDMETHYLESTER
7353891
METHYL45BIS(CHLOROMETHYL)2THIOPHENECARBOXYLATE
METHYL45BIS(CHLOROMETHYL)THIOPHENE2CARBOXYLATE
MFCD04969584
ZINC000002537409
ZINC2537409
COC(=O)C1=CC(=C(S1)CCl)CCl
InChI=1SC8H8Cl2O2Sc1128(11)625(39)7(410)136h2H34H21H3
BBL003974
Synonyms: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-ethyl-1,2-oxazole-3-carboxylicacid
Smiles: CCc1onc(c1Cc1c(C)n[nH]c1C)C(=O)O
CCc1onc(c1Cc1c(C)n(nH)c1C)C(=O)O
MFCD08685647
ZINC000009355846
ZINC9355846
1032296448
4((35DIMETHYL1HPYRAZOL4YL)METHYL)5ETHYL12OXAZOLE3CARBOXYLICACID
4((35DIMETHYL1HPYRAZOL4YL)METHYL)5ETHYLISOXAZOLE3CARBOXYLICACID
CCC1=C(C(=NO1)C(=O)O)CC2=C(NN=C2C)C
InChI=1SC12H15N3O3c14109(11(12(16)17)151810)586(2)13147(8)3h45H213H3(H1314)(H1617)
BBL003975
Synonyms: 3,3-dimethyl-3,4-dihydroquinoxalin-2(1H)-one
Smiles: O=C1Nc2ccccc2NC1(C)C
O=C1Nc2ccccc2NC1(C)C
QUINOXALIN2(1H)ONE34DIHYDRO33DIMETHYL
ZINC03886454
ZINC3886454
2(1H)QUINOXALINONE34DIHYDRO33DIMETHYL(9CI)
2QUINOXALINONE34DIHYDRO33DIMETHYL
33DIMETHYL134TRIHYDROQUINOXALIN2ONE
33DIMETHYL14DIHYDROQUINOXALIN2ONE
33DIMETHYL34DIHYDRO1HQUINOXALIN2ONE
33DIMETHYL34DIHYDRO2(1H)QUINOXALINONE
33DIMETHYL34DIHYDROQUINOXALIN2(1H)ONE
33DIMETHYL34DIHYDROQUINOXALIN2OL
33DIMETHYL34DIHYDROQUINOXALIN2ONE
33DIMETHYL34DIHYDROQUINOXALINE2(1H)ONE
34DIHYDRO33DIMETHYL2(1H)QUINOXALINONE
34DIHYDRO33DIMETHYLQUINOXALIN2(1H)ONE
80636302
CC1(C(=O)NC2=CC=CC=C2N1)C
InChI=1SC10H12N2Oc110(2)9(13)11753468(7)1210h3612H12H3(H1113)
BBL003976
Synonyms: 1-[4-(acetylamino)phenyl]-5-oxopyrrolidine-3-carboxylicacid
Smiles: CC(=O)Nc1ccc(cc1)N1CC(CC1=O)C(=O)O
CC(=O)Nc1ccc(cc1)N1CC(CC1=O)C(=O)O
1(4(ACETYLAMINO)PHENYL)5OXOPYRROLIDINE3CARBOXYLICACID
1(4ACETAMIDOPHENYL)5OXOPYRROLIDINE3CARBOXYLICACID
1(4ACETYLAMINOPHENYL)5OXOPYRROLIDINE3CARBOXYLICACID
133749163
3PYRROLIDINECARBOXYLICACID1(4(ACETYLAMINO)PHENYL)5OXO
CC(=O)NC1=CC=C(C=C1)N2CC(CC2=O)C(=O)O
InChI=1SC13H14N2O4c18(16)14102411(5310)1579(13(18)19)612(15)17h259H67H21H3(H1416)(H1819)
BBL003977
Synonyms: ethyl(4-oxo-3,4-dihydrophthalazin-1-yl)acetate
Smiles: CCOC(=O)Cc1n[nH]c(=O)c2c1cccc2
CCOC(=O)Cc1n(nH)c(=O)c2c1cccc2
ETHYL(4OXO34DIHYDROPHTHALAZIN1YL)ACETATE
ETHYL12DIHYDRO1OXOPHTHALAZIN4YLACETATE
ETHYL2(4OXO34DIHYDRO1PHTHALAZINYL)ACETATE
ETHYL2(4OXO34DIHYDROPHTHALAZIN1YL)ACETATE
ETHYL2(4OXO3HPHTHALAZIN1YL)ACETATE
ETHYL34DIHYDRO4OXO1PHTHALAZINEACETATE
ETHYL4OXO3HPHTHALAZIN1YLACETATE
(4OXO34DIHYDROPHTHALAZIN1YL)ACETICACIDETHYLESTER
1PHTHALAZINEACETICACID34DIHYDRO4OXOETHYLESTER
25947131
4OXO34DIHYDRO1PHTHALAZINEACETICACIDETHYLESTER
MFCD00024142
ZINC000008652362
ZINC08652362
ZINC8652362
CCOC(=O)CC1=NNC(=O)C2=CC=CC=C21
InChI=1SC12H12N2O3c121711(15)710853469(8)12(16)141310h36H27H21H3(H1416)
BBL003978
Synonyms: 2-chloro-N-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]acetamide
Smiles: CCSc1nsc(n1)NC(=O)CCl
CCSc1nsc(n1)NC(=O)CCl
ZINC02510414
ZINC2510414
2CHLORON(3(ETHYLSULFANYL)124THIADIAZOL5YL)ACETAMIDE
2CHLORON(3(ETHYLTHIO)124THIADIAZOL5YL)ACETAMIDE
2CHLORON(3ETHYLSULFANYL(124)THIADIAZOL5
2CHLORON(3ETHYLSULFANYL(124)THIADIAZOL5YL)ACETAMIDE
2CHLORON(3ETHYLSULFANYL124THIADIAZOL5YL)ACETAMIDE
2CHLORON(3ETHYLTHIO(124THIADIAZOL5YL))ACETAMIDE
575497153
CCSC1=NSC(=N1)NC(=O)CCl
InChI=1SC6H8ClN3OS2c1212695(13106)84(11)37h23H21H3(H891011)
BBL003979
Synonyms: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylicacid
Smiles: CC(=O)c1c(C)[nH]c(c1C)C(=O)O
CC(=O)c1c(C)(nH)c(c1C)C(=O)O
MFCD00022374
ZINC000000062274
ZINC62274
1HPYRROLE2CARBOXYLICACID4ACETYL35DIMETHYL
2386289
2PYRROLECARBOXYLICACID4ACETYL35DIMETHYL
35DIMETHYL4ACETYLPYRROLE2CARBOXYLICACID
4ACETYL35DIMETHYL1HPYRROLE2CARBOXYLICACID
4ACETYL35DIMETHYL2PYRROLECARBOXYLICACID
4ACETYL35DIMETHYLPYRROLE2CARBOXYLICACID
4ACETYL35DIMETHYLPYRROLECARBOXYLICACID
CC1=C(NC(=C1C(=O)C)C)C(=O)O
InChI=1SC9H11NO3c147(6(3)11)5(2)108(4)9(12)13h10H13H3(H1213)
BBL003980
Synonyms: 3-methyl-1-(2-methylpropyl)-1H-pyrazole-4-sulfonylchloride
Smiles: CC(Cn1nc(c(c1)S(=O)(=O)Cl)C)C
CC(Cn1nc(c(c1)S(=O)(=O)Cl)C)C
CHLORO(3METHYL1(2METHYLPROPYL)PYRAZOL4YL)SULFONE
1006453742
1ISOBUTYL3METHYL1HPYRAZOLE4SULFONYLCHLORIDE
3METHYL1(2METHYLPROPYL)1HPYRAZOLE4SULFONYLCHLORIDE
3METHYL1(2METHYLPROPYL)PYRAZOLE4SULFONYLCHLORIDE
ZINC59681490
CC1=NN(C=C1S(=O)(=O)Cl)CC(C)C
InChI=1SC8H13ClN2O2Sc16(2)41158(7(3)1011)14(912)13h56H4H213H3
BBL003981
Synonyms: 2-{[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}ethanol
Smiles: OCCNCc1c(C)nn(c1C)C
OCCNCc1c(C)nn(c1C)C
ZINC000009286900
ZINC9286900
400877089
2(((135TRIMETHYL1HPYRAZOL4YL)METHYL)AMINO)ETHANOL
2(((135TRIMETHYL1HPYRAZOL4YL)METHYL)AMINO)ETHANOLDIHYDROCHLORIDE
2(((TRIMETHYLPYRAZOL4YL)METHYL)AMINO)ETHANOL
MFCD08691729
2((135trimethylpyrazol4yl)methylamino)ethanol
CC1=C(C(=NN1C)C)CNCCO
InChI=1SC9H17N3Oc179(6104513)8(2)12(3)117h1013H46H213H3
BBL003982
Synonyms: 4-methyl-2-(morpholin-4-yl)-1,3-thiazole-5-carbaldehyde
Smiles: O=Cc1sc(nc1C)N1CCOCC1
O=Cc1sc(nc1C)N1CCOCC1
ZINC03284946
ZINC3284946
4METHYL2(4MORPHOLINYL)5THIAZOLECARBOXALDEHYDE
4METHYL2(MORPHOLIN4YL)13THIAZOLE5CARBALDEHYDE
4METHYL2MORPHOLIN4YL13THIAZOLE5CARBALDEHYDE
4METHYL2MORPHOLIN4YLTHIAZOLE5CARBALDEHYDE
4METHYL2MORPHOLINOTHIAZOLE5CARBALDEHYDE
5THIAZOLECARBOXALDEHYDE4METHYL2(4MORPHOLINYL)
90437722
CC1=C(SC(=N1)N2CCOCC2)C=O
InChI=1SC9H12N2O2Sc178(612)149(107)1124135311h6H25H21H3
BBL003983
Synonyms: 3-phenyl-1H-1,2,4-triazol-5-amine
Smiles: Nc1[nH]nc(n1)c1ccccc1
Nc1(nH)nc(n1)c1ccccc1
ZINC000017285513
ZINC17285513
MFCD00465593
1H124TRIAZOL3AMINE5PHENYL
1H124TRIAZOL3AMINE5PHENYL(9CI)
1H124TRIAZOL5AMINE3PHENYL
1H124TRIAZOLE3AMINO5PHENYL
1H14TRIAZOL3AMINE5PHENYL
1H14TRIAZOLE3AMINO5PHENYL
2FENIL5AMINO134TRIAZOLO
3AMINO5PHENYL124TRIAZOLE
3AMINO5PHENYL1H124TRIAZOLE
3PHENYL1H124TRIAZOL5AMINE
3PHENYL1H124TRIAZOLE5YLAMINE
4922989
5AMINO2PHENYL1H134TRIAZOLE
5PHENYL1H(124)TRIAZOL3YLAMINE
5PHENYL1H124TRIAZOL3AMINE
5PHENYL1H124TRIAZOLE3YLAMINE
5PHENYL2H124TRIAZOL3AMINE
5PHENYL4H(124)TRIAZOL3YLAMINE
5PHENYL4H124TRIAZOL3AMINE
C1=CC=C(C=C1)C2=NC(=NN2)N
InChI=1SC8H8N4c98107(11128)6421356h15H(H39101112)
BBL003984
Synonyms: methyl3-(4-formyl-3,5-dimethyl-1H-pyrazol-1-yl)propanoate
Smiles: COC(=O)CCn1nc(c(c1C)C=O)C
COC(=O)CCn1nc(c(c1C)C=O)C
949020604
METHYL3(4FORMYL35DIMETHYL1HPYRAZOL1YL)PROPANOATE
METHYL3(4FORMYL35DIMETHYLPYRAZOL1YL)PROPANOATE
MFCD12405235
ZINC000022637556
ZINC22637556
CC1=C(C(=NN1CCC(=O)OC)C)C=O
InChI=1SC10H14N2O3c179(613)8(2)12(117)5410(14)153h6H45H213H3
BBL003985
Synonyms: 2-methoxy-N-methylpropan-1-amine
Smiles: CNCC(OC)C
CNCC(OC)C
MFCD06248042
ZINC000013568036
ZINC000013568037
(2METHOXYPROPYL)METHYLAMINE
(2METHOXYPROPYL)METHYLAMINEHYDROCHLORIDE
1PROPANAMINEN1METHYL2METHOXY
2METHOXYNMETHYL1PROPANAMINE
2METHOXYNMETHYLPROPAN1AMINE
883543359
CC(CNC)OC
InChI=1SC5H13NOc15(73)462h56H4H213H3
BBL003986
Synonyms: 2-[(4-amino-3-methylphenyl)(ethyl)amino]ethanol
Smiles: OCCN(c1ccc(c(c1)C)N)CC
OCCN(c1ccc(c(c1)C)N)CC
ZINC000000394925
ZINC00394925
ZINC394925
2((4AMINO3METHYLPHENYL)(ETHYL)AMINO)ETHANOL
MTOLUIDINE4AMINONETHYLN(BETAHYDROXYETHYL)
2(4AMINO(ETHYL)3METHYLANILINO)1ETHANOL
2(4AMINON1ETHYLMTOLUIDINO)ETHANOLSULFATEHYDRATE
2(4AMINONETHYL3METHYLANILINO)ETHANOL
2(4AMINONETHYLMTOLUIDINO)ETHANOL
2359515
4AMINONETHYLN(BETAHYDROXYETHYL)MTOLUIDINE
ETHANOL2((4AMINO3METHYLPHENYL)ETHYLAMINO)SULFATE(11)(SALT)
MFCD00476518
NHYDROXYETHYLNETHYL3METHYLPPHENYLENEDIAMINE
CCN(CCO)C1=CC(=C(C=C1)N)C
InChI=1SC11H18N2Oc1313(6714)104511(12)9(2)810h45814H36712H212H3
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