FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STK567895
Synonyms: (5Z)-2,6-dihydroxy-5-{1-[(tetrahydrofuran-2-ylmethyl)amino]propylidene}pyrimidin-4(5H)-one
Smiles: CC/C(=C/1\C(=NC(=NC1=O)O)O)/NCC1CCCO1

STK567896
Synonyms: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(2-methoxy-5-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(ccc1OC)[N+](=O)[O-])/c1scc(n1)c1ccc2c(c1)OCO2

STK567897
Synonyms: 2-({(E)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)-4-(methylsulfonyl)butanoicacid
Smiles: Cc1ccc(cc1)N1C(=NC(=O)/C(=C\NC(C(=O)O)CCS(=O)(=O)C)/C1=O)S

STK567899
Synonyms: 6-amino-4-(4-ethylphenyl)-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)CC)c([nH]n2)c1cccc(c1)OC

STK567900
Synonyms: 5-(hydroxymethyl)-2-methyl-4-{(E)-[2-(4-methylquinolin-2-yl)hydrazinylidene]methyl}pyridin-3-ol
Smiles: OCc1cnc(c(c1/C=N/Nc1cc(C)c2c(n1)cccc2)O)C

STK567901
Synonyms: (5Z)-3-(3,4-dimethylphenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK567902
Synonyms: N-(4-phenoxyphenyl)-N'-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: CCCc1n[nH]/c(=N\C(=O)CCC(=O)Nc2ccc(cc2)Oc2ccccc2)/s1

STK567903
Synonyms: N-[(2Z)-3-[(4-bromo-2-methylphenyl)amino]quinoxalin-2(1H)-ylidene]-2,5-dimethylbenzenesulfonamide
Smiles: Brc1ccc(c(c1)C)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cc(C)ccc1C

STK567904
Synonyms: 8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccccc1OC)C(F)(F)F

STK567905
Synonyms: 6-(4-benzylpiperazin-1-yl)-N~2~-(2-methylpropyl)-5-nitropyrimidine-2,4-diamine
Smiles: CC(CNc1nc(N2CCN(CC2)Cc2ccccc2)c(c(n1)N)[N+](=O)[O-])C

STK567906
Synonyms: (5Z)-3-(2-fluorophenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1F)O

STK567907
Synonyms: methyl6'-amino-1-(2-amino-2-oxoethyl)-3'-methyl-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)N)c(C)[nH]n2

STK567909
Synonyms: 3-[4-(2-ethoxyphenoxy)butyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCOc1ccccc1OCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK567910
Synonyms: (E)-{2-(3-butoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STK567911
Synonyms: (E)-[4-(benzyloxy)phenyl]{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCN1C(c2cccs2)/C(=C(/c2ccc(cc2)OCc2ccccc2)\[O-])/C(=O)C1=O)C

STK567912
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nnc1c1cccc(c1)C

STK567914
Synonyms: N-[(2Z)-3-[(2-methoxy-5-methylphenyl)amino]quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: COc1ccc(cc1Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C)C

STK567915
Synonyms: 3-[(2,4-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)nnc1c1cccc(c1)C

STK567916
Synonyms: (4Z)-4-(4-methoxy-3-nitrobenzylidene)-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\N=C(OC1=O)c1cccc2c1cccc2

STK567917
Synonyms: 2-methoxy-6-[4-(phenylsulfanyl)quinazolin-2-yl]phenol
Smiles: COc1cccc(c1O)c1nc(Sc2ccccc2)c2c(n1)cccc2

STK567918
Synonyms: 2-methylpropyl[(2Z)-5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
Smiles: COc1cc(ccc1OC)Cc1n[nH]/c(=N/C(=O)OCC(C)C)/s1

STK567919
Synonyms: 6'-amino-3'-butyl-1-methyl-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: CCCCc1[nH]nc2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)C

STK567920
Synonyms: (E)-{2-(4-bromophenyl)-1-[3-(diethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CC[NH+](CCCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C1=O)CC

STK567921
Synonyms: [5,10,15,20-tetraphenylporphyrinato(2-)-kappa~2~N~21~,N~23~]nickel
Smiles: c1ccc(cc1)C1=C2C=CC(=N2)C(=c2n3[Ni]n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1ccccc1)c1ccccc1)c1ccccc1

STK567922
Synonyms: (5E)-1-cyclopropyl-5-{[(3,3-diphenylpropyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NCCC(c1ccccc1)c1ccccc1)C1CC1

STK567923
Synonyms: 4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N'-[(E)-(4-nitrophenyl)methylidene]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK567924
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(3-methoxypropyl)-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCOC

STK567925
Synonyms: N-[(2Z)-3-{[4-(butan-2-yl)phenyl]amino}quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: CCC(c1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C)C

STK567926
Synonyms: 4-ethoxy-N-[(4E)-2-methyl[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]aniline
Smiles: CCOc1ccc(cc1)/N=c\1/[nH]c(C)nc2c1oc1c2cccc1

STK567927
Synonyms: (4E)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK567929
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc2c(c1)OCCO2

STK567930
Synonyms: (4E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3,4-diethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK567931
Synonyms: 4-(4-bromophenyl)-N-(3,4-dichlorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Smiles: Brc1ccc(cc1)c1c(C(=O)Nc2ccc(c(c2)Cl)Cl)n2c3c1CCCCn3c(n2)c1ccccc1

STK567932
Synonyms: 4-{4-[(4-chlorophenoxy)methyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)COc2ccc(cc2)Cl)/s1

STK567933
Synonyms: ethylN-({[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate
Smiles: CCOC(=O)CNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK567934
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nnc1COc1ccccc1

STK567935
Synonyms: 4-[(E)-{(2E)-[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6,7,9-hexahydro-8H-purin-8-ylidene]hydrazinylidene}methyl]phenylfuran-2-carboxylate
Smiles: O=C(c1ccco1)Oc1ccc(cc1)/C=N/N=c/1\[nH]c2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK567936
Synonyms: (1'R,2'R)-2'-(4-chlorophenyl)-1'-[(3-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)[C@H]1[C@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK567937
Synonyms: 3-[(3-chlorobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1cccc(c1)Cl

STK567938
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-cyclohexyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCN2Cc1ccccc1Cl)C1CCCCC1

STK567939
Synonyms: 5'-(naphthalen-1-yl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C1NC2(C3C1C(=O)N(C3=O)c1cccc3c1cccc3)C(=O)Nc1c2cccc1)C

STK567940
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CSc2nncn2C)c2nonc2[NH3+])ccc1[O-]

STK567941
Synonyms: (8E)-8-[(2E)-(furan-2-ylmethylidene)hydrazinylidene]-3,7-dimethyl-1-(4-methylbenzyl)-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(=O)c2n(C)/c(=N/N=C/c3ccco3)/[nH]c2n(c1=O)C

STK567942
Synonyms: 5-(3,4-dichlorophenyl)-3-(4-hydroxyphenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)Cl)c1cccc(c1)[N+](=O)[O-]

STK567943
Synonyms: (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dioxo-5-{[2-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium-8-yl)hydrazinyl]methylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: COc1cc(CCN2C(=O)N=C(/C(=C/NNc3[nH+]c4c(n3C)c(=O)n(c(=O)n4C)C)/C2=O)[O-])ccc1OC

STK567945
Synonyms: (4E)-5-(3-ethoxy-4-propoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK567946
Synonyms: N-[(2Z)-3-[(2-fluorophenyl)amino]quinoxalin-2(1H)-ylidene]-2,5-dimethylbenzenesulfonamide
Smiles: Cc1ccc(c(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccccc1F)C

STK567947
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK567948
Synonyms: N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cccc(c2)OCc2ccccc2)nnc1c1ccc(cc1)OC

STK567949
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{(E)-[4-(propan-2-yloxy)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC(Oc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(C)C)c1nonc1N)C

STK567950
Synonyms: 2'-(2,4-dimethoxyphenyl)-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)OC)C1C(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C

STK567954
Synonyms: (E)-[4,5-dioxo-1-(pyridinium-3-ylmethyl)-2-(pyridin-3-yl)pyrrolidin-3-ylidene]{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1cccnc1)Cc1ccc[nH+]c1)/c1ccc(cc1)OCc1ccccc1C

STK567955
Synonyms: 8-(azepanium-1-ylmethyl)-3-(4-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-olate
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCCCC1)[O-]

STK567957
Synonyms: (5E)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/S1

STK567958
Synonyms: 1-(3,4-dihydroxyphenyl)-2-{[4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccc(c(c1)O)O)CSc1nnc(n1Cc1ccco1)c1ccccc1

STK567959
Synonyms: (2Z)-N~6~-(3-fluorophenyl)-2-[(2-fluorophenyl)imino]-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: Fc1cccc(c1)Nc1[nH]/c(=N/c2ccccc2F)/nc(c1[N+](=O)[O-])N

STK567962
Synonyms: N-[(3E)-1-butyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]pyridine-3-carboxamide
Smiles: CCCCn1[nH]/c(=N/C(=O)c2cccnc2)/c2c1nc1cc(C)ccc1c2

STK567963
Synonyms: 1-(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)-3-(4-fluorophenyl)guanidine
Smiles: Oc1nc(nc(c1)CSc1ccc(cc1)Cl)NC(=N)Nc1ccc(cc1)F

STK567964
Synonyms: (5E)-1-cyclopropyl-5-({[2-(morpholin-4-ium-4-yl)ethyl]amino}methylidene)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: O=C1N=C([S-])N(C(=O)/C/1=C/NCC[NH+]1CCOCC1)C1CC1

STK567965
Synonyms: (4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(c2cc(OC)c(c(c2)OC)OC)/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C1=O

STK567966
Synonyms: 2-{[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C

STK567967
Synonyms: N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(propan-2-yl)propanamide
Smiles: CCC(=O)N(C(C)C)Cc1cc2cccc(c2[nH]c1=O)C

STK567968
Synonyms: (5E)-5-{1-[(2-ammoniocyclohexyl)amino]ethylidene}-1-cyclohexyl-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C(\NC2CCCCC2[NH3+])/C)/C(=O)N1C1CCCCC1

STK567969
Synonyms: 2-(4-methoxyphenyl)-N-[(3Z)-6-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)CC(C)C

STK567970
Synonyms: (6Z)-5-imino-6-{3-methoxy-4-[3-(3-methylphenoxy)propoxy]benzylidene}-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCCCOc1cccc(c1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1

STK567971
Synonyms: N-[(2Z)-3-(3-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1c1cccc(c1)Cl)CS(=O)(=O)C2

STK567972
Synonyms: 4-{[2'-(2-ethoxyphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-1'-yl]carbonyl}phenylacetate
Smiles: CCOc1ccccc1C1C(C(=O)c2ccc(cc2)OC(=O)C)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK567973
Synonyms: 3-(4-ethoxyphenyl)-6-hydroxy-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-2-sulfanylpyrimidin-4(3H)-one
Smiles: CCOc1ccc(cc1)n1c(S)nc(c(c1=O)C1OC(=O)c2c1cccc2)O

STK567974
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C)C

STK567975
Synonyms: 10-(3-chloro-4-fluorophenyl)-9,11-dioxo-N-[3-(trifluoromethyl)phenyl]-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: O=C(C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)F)cccc3)Nc1cccc(c1)C(F)(F)F

STK567976
Synonyms: (2Z)-2-[(3-chlorophenyl)imino]-N~6~-(2,5-dimethoxyphenyl)-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: COc1ccc(c(c1)Nc1[nH]/c(=N/c2cccc(c2)Cl)/nc(c1[N+](=O)[O-])N)OC

STK567977
Synonyms: N-[(2Z)-3-[(4-ethylphenyl)amino]quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)F

STK567979
Synonyms: diphenylmethyl10-(4-methoxyphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxylate
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)C1N(C2C(=O)OC(c2ccccc2)c2ccccc2)C=Cc2c1cccc2

STK567980
Synonyms: 4-(4-chlorophenyl)-N-(4-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(cc1)Cl

STK567981
Synonyms: 10a-[(E)-2-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}ethenyl]-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCOc1cc(ccc1OCc1ccccc1Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C

STK567982
Synonyms: N-[(2Z)-5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: COc1cc(ccc1OC)Cc1n[nH]/c(=N/C(=O)CCc2ccccc2)/s1

STK567983
Synonyms: N-[(2Z)-5-(furan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCC(=O)/N=c\1/[nH]nc(s1)c1ccco1

STK567984
Synonyms: 4-{[(E)-(2,5-dimethoxyphenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(c(c1)/C=N/n1c(S)nnc1c1n[nH]c(c1)C)OC

STK567986
Synonyms: N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-N'-(2,3-dimethylphenyl)butanediamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C1CCCCC1)CCC(=O)Nc1cccc(c1C)C

STK567987
Synonyms: (E)-[4-(benzyloxy)phenyl][4,5-dioxo-2-phenyl-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccc(cc2)OCc2ccccc2)/[O-])/C(N1Cc1ccc[nH+]c1)c1ccccc1

STK567988
Synonyms: 4-chloro-N-ethyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CCN(C(=O)c1ccc(cc1)Cl)Cc1cc2cccc(c2[nH]c1=O)C

STK567989
Synonyms: 3,4,5-triethoxy-N-[(3Z)-6-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)CCC

STK567990
Synonyms: 2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(2,4,6-tribromophenyl)acetamide
Smiles: O=C(Nc1c(Br)cc(cc1Br)Br)CSc1ncnc2c1cnn2c1ccc(cc1)C

STK567991
Synonyms: N'-{(1E)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}pyridine-4-carbohydrazide
Smiles: C=CCN1C(=O)N=C(/C(=C(\NNC(=O)c2ccncc2)/CC)/C1=O)O

STK567992
Synonyms: 3-(2-chlorophenyl)-7-(4-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1ccccc1Cl

STK567993
Synonyms: (3'E)-3'-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-ethyl-1'-(3-methoxypropyl)spiro[indole-3,2'-pyrrolidine]-2,4',5'(1H)-trione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C21C(=O)N(c1c2cccc1)CC

STK567994
Synonyms: 2,5-dimethyl-N-[(2Z)-3-[(4-phenoxyphenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Cc1ccc(c(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)Oc1ccccc1)C

STK567995
Synonyms: (5Z)-6-hydroxy-3-(4-methoxyphenyl)-5-{1-[(1-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(/NC(c2ccccc2)C)\C)/C1=O)O

STK567996
Synonyms: 1-(2,4-dimethylphenyl)-3-{(Z)-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}[(3-methoxyphenyl)amino]methylidene}thiourea
Smiles: COc1cccc(c1)N/C(=N/C(=S)Nc1ccc(cc1C)C)/N=c\1/nc(C)cc([nH]1)C

STK567997
Synonyms: (4E)-5-(3,4-diethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK567998
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CC(c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccco1)C

STK567999
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CC[NH+](CCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C1=O)CC

STK568000
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C\1/C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1nnc(s1)SCc1ccccc1F)/O

STK568002
Synonyms: N-(3-chloro-4-methylphenyl)-11-[4-(dimethylamino)phenyl]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CN(c1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1)C

STK568003
Synonyms: N-tert-butyl-2-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: O=C(N(C(C)(C)C)Cc1cc2ccccc2[nH]c1=O)C(C)C

STK568005
Synonyms: methylN-[(4-fluorobenzyl)carbamoyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)NCc1ccc(cc1)F

STK568006
Synonyms: (8E)-8-[(2E)-(5-bromo-2-hydroxybenzylidene)hydrazinylidene]-7-[(2E)-3-chlorobut-2-en-1-yl]-1,3-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: C/C(=C\Cn1/c(=N/N=C/c2cc(Br)ccc2O)/[nH]c2c1c(=O)n(c(=O)n2C)C)/Cl

STK568007
Synonyms: 2-{5-[(4-nitrobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}pyrazine
Smiles: C=CCn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1nccnc1

STK568008
Synonyms: (E)-{2-(2,4-dichlorophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1Cl)Cl)CCC[NH+](C)C)/[O-])C

STK568009
Synonyms: N-[(4E)-2-ethyl[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]-2,5-dimethoxyaniline
Smiles: COc1ccc(c(c1)/N=c\1/[nH]c(CC)nc2c1oc1c2cccc1)OC

STK568010
Synonyms: 7'-chloro-2'-(2,5-dimethoxyphenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)C1C(C(=O)c2cccs2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl)OC

STK568011
Synonyms: N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1cccc2c1cccc2)N/N=C/c1cccc(c1)OCc1ccccc1

STK568013
Synonyms: N-(3-methoxyphenyl)-N'-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: COc1cccc(c1)NC(=O)CCC(=O)/N=c\1/[nH]nc(s1)CC(C)C

STK568014
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK568015
Synonyms: 7-cyclohexyl-4-hydroxy-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: FC(C1(N=C(Nc2c1c(O)nc(=O)n2CCc1ccccc1)C1CCCCC1)C(F)(F)F)(F)F

STK568016
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(furan-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2cccs2)/O)/C(N1c1nnc(s1)SCc1ccccc1)c1ccco1

STK568017
Synonyms: N-[(2Z)-4-hydroxy-5-(propan-2-yl)-1,3-thiazol-2(5H)-ylidene]undec-10-enamide
Smiles: C=CCCCCCCCCC(=O)/N=C\1/N=C(C(S1)C(C)C)O

STK568018
Synonyms: 3-(5-{(Z)-[5-iminio-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}furan-2-yl)benzoate
Smiles: O=C1N=c2sc(nn2C(=[NH2+])/C/1=C/c1ccc(o1)c1cccc(c1)C(=O)[O-])c1cccnc1

STK568021
Synonyms: N-[(2Z)-3-[(4-fluorophenyl)amino]quinoxalin-2(1H)-ylidene]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)F

STK568023
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-ethoxyphenyl)-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK568024
Synonyms: (5E)-1-(1,3-benzodioxol-5-yl)-2-hydroxy-5-[(5-phenylfuran-2-yl)methylidene]pyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(O)N(C(=O)/C/1=C/c1ccc(o1)c1ccccc1)c1ccc2c(c1)OCO2

STK568025
Synonyms: (4Z)-1-(4-ethoxyphenyl)-5-(4-hydroxy-3-methoxyphenyl)-4-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)N1C(=O)C(=O)/C(=C(/C=C/c2ccccc2)\O)/C1c1ccc(c(c1)OC)O

STK568026
Synonyms: 2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate
Smiles: O=C(c1nnn(c1C(C)C)c1nonc1[NH3+])N/N=C/c1ccccc1[O-]

STK568027
Synonyms: 2-bromo-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1ccccc1Br)Cc1cc2cc(C)ccc2[nH]c1=O

STK568028
Synonyms: 3-(3,5-dichlorophenyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: N=C1SC2C(N1c1cc(Cl)cc(c1)Cl)CS(=O)(=O)C2

STK568029
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CC[NH+](C)C)/[O-]

STK568030
Synonyms: 4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2ccc(cc2)[N+](=O)[O-])/s1

STK568031
Synonyms: 6'-(dipentylamino)-3'-methyl-2'-(phenylamino)-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one
Smiles: CCCCCN(c1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)cc(c(c1)C)Nc1ccccc1)CCCCC

STK568033
Synonyms: (5Z)-5-{1-[(3,3-diphenylpropyl)amino]ethylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(/NCCC(c2ccccc2)c2ccccc2)\C)/C1=O)O

STK568034
Synonyms: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)CC(C)C

STK568035
Synonyms: 6-(2,4-dimethoxyphenyl)-2-methyl-7-(pyridin-3-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1cc(OC)ccc1C1Oc2ccc(cc2C2=C1C(c1cccnc1)n1c(N2)ncn1)C

STK568036
Synonyms: 3-(2,4-dichlorophenyl)-6-iodo-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(c(c1)Cl)n1c(/C=C/c2ccc(o2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK568037
Synonyms: N-{2-[biphenyl-4-yl(5-methylfuran-2-yl)methyl]-4,5-dimethoxyphenyl}-4-methylbenzenesulfonamide
Smiles: COc1cc(NS(=O)(=O)c2ccc(cc2)C)c(cc1OC)C(c1ccc(o1)C)c1ccc(cc1)c1ccccc1

STK568038
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CC[NH+](CCCN1C(c2ccccc2)/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C1=O)CC

STK568039
Synonyms: (2Z)-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl4-nitrobenzoate
Smiles: COc1ccc(c(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc(cc1)[N+](=O)[O-]

STK568043
Synonyms: methyl2-[3-(5-bromo-2-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cc(Br)ccc1OC

STK568044
Synonyms: (E)-{2-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: COc1cc(cc(c1O)Br)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK568045
Synonyms: 12-(2-chlorophenyl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2Cl)c2ccccc2n3)CCC1

STK568046
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(2-chlorophenyl)carbonyl]-5'-methyl-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: O=C([C@H]1N2c3ccccc3C(=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)C)c1ccc(cc1)[N+](=O)[O-]

STK568047
Synonyms: (5E)-1-ethyl-4,6-dioxo-5-{[(pyridinium-2-ylmethyl)amino]methylidene}-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: CCN1C(=NC(=O)/C(=C\NCc2cccc[nH+]2)/C1=O)[S-]

STK568048
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-4-{hydroxy[4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC(C)C)/O)/C1c1ccc(cc1OC)OC

STK568049
Synonyms: (5Z)-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C\c1cn[nH]c1c1ccccc1)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK568050
Synonyms: 2,2-dimethyl-N-[(3Z)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]propanamide
Smiles: CCCn1[nH]/c(=N\C(=O)C(C)(C)C)/c2c1nc1cc(C)ccc1c2

STK568051
Synonyms: 7-(3,4-dichlorophenyl)-2-(4-ethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccc(c(c1)Cl)Cl

STK568052
Synonyms: 3,4,5-triethoxy-N-[(3Z)-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c/1\[nH]n(c2c1cc1ccccc1n2)CCC

STK568053
Synonyms: (4E)-5-(4-fluorophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O

STK568054
Synonyms: (5E)-1-(3-chloro-4-methylphenyl)-5-({[3-(dimethylammonio)propyl]amino}methylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: C[NH+](CCCN/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)[O-])C

STK568056
Synonyms: 3-(3,4-dimethoxyphenyl)-5-(3-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(ccc1OC)C1=NOC2C1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-]

STK568057
Synonyms: 2'-[(4-fluorophenyl)carbonyl]-1'-[(3-methoxyphenyl)carbonyl]-5',7'-dimethyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)C1N2c3ccc(cc3C(=CC2C2(C1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)C)C

STK568058
Synonyms: 2-fluoro-N-[(3Z)-6-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2ccccc2F)/c2c1nc1ccc(cc1c2)C)C

STK568059
Synonyms: 4-{[(E)-(9-ethyl-9H-carbazol-3-yl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: CCn1c2ccc(cc2c2c1cccc2)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

STK568060
Synonyms: 2-{[4-(4-bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide
Smiles: COc1cc2c(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)Br)c1ccncc1)oc1c2cccc1

STK568061
Synonyms: 10a-{(E)-2-[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]ethenyl}-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCOc1ccc(cc1)c1nn(cc1/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C)c1ccccc1

STK568062
Synonyms: 2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)N/N=C/c1c(O)ccc2c1cccc2

STK568063
Synonyms: [6-ethoxy-4-oxido-3-(phenylcarbonyl)quinoxalin-2-yl]methyl3-nitrobenzoate
Smiles: CCOc1ccc2c(c1)[n+]([O-])c(c(n2)COC(=O)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1

STK568064
Synonyms: N-[(2E)-5-[(3-bromobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Brc1cccc(c1)CSc1n[nH]/c(=N\C(=O)CSc2nnc(n2c2ccccc2)c2cccnc2)/s1

STK568065
Synonyms: N-(4-bromo-2-methylphenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)Br)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK568066
Synonyms: (4E)-4-{[4-(benzyloxy)phenyl](hydroxy)methylidene}-1-(2-methoxyethyl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)OCc2ccccc2)\O)/C(=O)C1=O

STK568067
Synonyms: (E)-{2-(4-chlorophenyl)-1-[3-(diethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CC[NH+](CCCN1C(c2ccc(cc2)Cl)/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C1=O)CC

STK568069
Synonyms: (5E)-5-[(hexylamino)methylidene]-1-(naphthalen-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCCCCN/C=C/1\C(=O)N=C(N(C1=O)c1cccc2c1cccc2)S

STK568070
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: C[NH+](CCN1C(c2cccs2)/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C1=O)C

STK568071
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cc(Cl)ccc1C

STK568072
Synonyms: 7'-chloro-2'-(3-methoxyphenyl)-1'-[(4-methylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C1C(C(=O)c2ccc(cc2)C)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl

STK568073
Synonyms: 4-({[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)C#N)nnc1c1ccccc1Cl

STK568074
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-phenylethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1CCc1ccccc1)c1cccs1

STK568075
Synonyms: 4-(4-chlorophenyl)-3-[(2,5-dimethylbenzyl)sulfanyl]-5-(2-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCc1cc(C)ccc1C

STK568076
Synonyms: N-[(2Z)-3-[(3-bromophenyl)amino]quinoxalin-2(1H)-ylidene]thiophene-2-sulfonamide
Smiles: Brc1cccc(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccs1

STK568077
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[4-ethyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1cccc(c1)C

STK568078
Synonyms: (5-hydroxy-4,6-dinitro-1-benzofuran-3-yl)(4-methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)c1coc2c1c([N+](=O)[O-])c(c(c2)[N+](=O)[O-])O

STK568080
Synonyms: 4-(4-chlorophenyl)-3-(4-methylphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(cc1)C

STK568083
Synonyms: N-[3-(dimethylamino)propyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CN(CCCNC(=O)c1c(O)c2ccccc2n(c1=O)C)C

STK568084
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-[3-methoxy-4-(3-methylbutoxy)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: COc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STK568085
Synonyms: 6-amino-3-(3-methoxyphenyl)-4-(2-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1[N+](=O)[O-])c([nH]n2)c1cccc(c1)OC

STK568086
Synonyms: 3-[(2,6-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(nnc1SCc1c(Cl)cccc1Cl)COc1ccc(cc1)C

STK568088
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(4-nitrophenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1nccs1)/O

STK568090
Synonyms: (1S)-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-2-methylpropan-1-amine
Smiles: N[C@H](c1nnc(o1)SCc1ccc(cc1)Cl)C(C)C

STK568091
Synonyms: N-[(2Z)-3-{[4-chloro-3-(trifluoromethyl)phenyl]amino}quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: Cc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(c(c1)C(F)(F)F)Cl

STK568092
Synonyms: (2Z)-6-(2,6-dimethylmorpholin-4-yl)-2-[(3-methylphenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine
Smiles: CC1OC(C)CN(C1)c1[nH]/c(=N/c2cccc(c2)C)/nc(c1[N+](=O)[O-])N

STK568094
Synonyms: 4-fluoro-N-[(2Z)-3-[(3-fluorophenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)F

STK568095
Synonyms: N-[(2Z)-3-[(2-ethylphenyl)amino]quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: CCc1ccccc1Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C

STK568096
Synonyms: 4-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCc1ccc(cc1)[N+](=O)[O-]

STK568098
Synonyms: 2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK568100
Synonyms: 6-hydroxy-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(N/N=C/c2ccncc2)nc2c1c(O)nc(=O)n2C)COc1ccccc1

STK568101
Synonyms: 5-hydroxy-7,7-dimethyl-2-(methylsulfanyl)-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1cc(OC)c(c(c1)OC)OC

STK568102
Synonyms: ethyl3-({[(3-nitrophenyl)carbonyl]oxy}methyl)quinoxaline-2-carboxylate1-oxide
Smiles: CCOC(=O)c1c(COC(=O)c2cccc(c2)[N+](=O)[O-])nc2c([n+]1[O-])cccc2

STK568103
Synonyms: N-[(2E)-4-(2-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=c\1/scc([nH]1)c1ccccc1Cl

STK568104
Synonyms: 2-(1,3-benzodioxol-5-yl)-9-chloro-5-(2-chloro-5-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: Clc1ccc2c(c1)C1CC(=NN1C(O2)c1cc(ccc1Cl)[N+](=O)[O-])c1ccc2c(c1)OCO2

STK568105
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OC)C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK568106
Synonyms: N-(2-chlorobenzyl)-N'-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)NCc2ccccc2Cl)/s1

STK568107
Synonyms: 2-(4-chlorophenyl)-3-[5-(2,4,6-trimethylphenoxy)pentyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1c(C)cc(cc1C)C

STK568108
Synonyms: (5E)-3-benzyl-5-[1-(cyclopropylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\NC2CC2)/C)/C(=O)N1Cc1ccccc1

STK568109
Synonyms: (4E)-5-(4-hydroxyphenyl)-4-{hydroxy[4-(piperidin-1-ylsulfonyl)phenyl]methylidene}-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(cc2)O)/C(=C(/c2ccc(cc2)S(=O)(=O)N2CCCCC2)\O)/C(=O)C1=O

STK568110
Synonyms: 1'-[(2-chlorophenyl)carbonyl]-5'-methyl-2'-[(4-methylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Cc1ccc(cc1)C(=O)C1C(C(=O)c2ccccc2Cl)N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C

STK568112
Synonyms: (E)-(4-butoxyphenyl){1-[3-(dimethylammonio)propyl]-2-(2-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)CCC[NH+](C)C)/[O-]

STK568113
Synonyms: N-[(2Z)-3-[(5-chloro-2-methylphenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Clc1ccc(c(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccccc1)C

STK568115
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: C[NH+](CCCN1C(c2ccc(cc2)O)/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C1=O)C

STK568117
Synonyms: N-[(3E)-1-ethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3-methylbutanamide
Smiles: CCn1[nH]/c(=N/C(=O)CC(C)C)/c2c1nc1ccccc1c2

STK568120
Synonyms: 4-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1ccc(c(c1)O)/C=N/n1c(=S)[nH]nc1c1n[nH]c(c1)C

STK568122
Synonyms: 8-[(diethylammonio)methyl]-4-oxo-3-[4-(propoxycarbonyl)phenoxy]-4H-chromen-7-olate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2C[NH+](CC)CC)[O-]

STK568123
Synonyms: N-(3-chlorophenyl)-4-(3,4-dimethylphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)Cl)n2c3c1CCCCn3c(c2)c1ccc(c(c1)C)C

STK568124
Synonyms: (E)-{2-(3,4-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Smiles: COc1cc(ccc1OC)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/[O-]

STK568125
Synonyms: N'-[(3Z)-1-({1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}methyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]pyridine-3-carbohydrazide
Smiles: O=C1/C(=N\NC(=O)c2cccnc2)/c2c(N1CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cccc2

STK568126
Synonyms: 7-[3-(1H-benzotriazol-1-ylmethyl)-4-methoxyphenyl]-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: COc1ccc(cc1Cn1nnc2c1cccc2)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK568127
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dibromo-4-methylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(Br)cc(cc2Br)C)nnc1COc1ccc(cc1)Cl

STK568128
Synonyms: N-[(2E)-5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]thiophene-2-carboxamide
Smiles: Fc1ccc(cc1)OCc1n[nH]/c(=N\C(=O)c2cccs2)/s1

STK568129
Synonyms: 2-(4-bromophenyl)-3-(2-{2-[4-(2-methylbutan-2-yl)phenoxy]ethoxy}ethyl)quinazolin-4(3H)-one
Smiles: CCC(c1ccc(cc1)OCCOCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Br)(C)C

STK568130
Synonyms: 3-(4-methoxyphenyl)-4-oxo-8-(piperidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: COc1ccc(cc1)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCCC1)[O-]

STK568131
Synonyms: N-[(2Z)-3-[(4-bromo-2-methylphenyl)amino]quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: Brc1ccc(c(c1)C)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C

STK568132
Synonyms: 8-(diethylamino)-6-hydroxy-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCN(c1nc2c(n1CCOc1ccccc1)c(O)nc(=O)n2C)CC

STK568133
Synonyms: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(2-carbamoylphenyl)ammonio]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: O=C(c1nnn(c1C[NH2+]c1ccccc1C(=O)N)c1nonc1N)N/N=C/c1ccccc1C(=O)[O-]

STK568134
Synonyms: 2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1COc1ccc(cc1)C

STK568136
Synonyms: (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[(4-ethoxyphenyl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)O

STK568138
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK568139
Synonyms: N-(2-bromo-4,6-difluorophenyl)-2-{[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: Fc1cc(F)c(c(c1)Br)NC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCC3

STK568140
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nnc1c1cccc(c1)C

STK568141
Synonyms: 6-amino-3-(4-ethoxy-3-methoxyphenyl)-4-(4-ethylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccc(cc1OC)c1[nH]nc2c1C(c1ccc(cc1)CC)C(=C(O2)N)C#N

STK568142
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(3-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK568143
Synonyms: 5-(4-bromophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1cc(ccc1Cl)C(F)(F)F

STK568145
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C)C

STK568146
Synonyms: 4-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)C)CCCC3)c1ccc(c(c1)C)C

STK568147
Synonyms: 2-(1,3-benzothiazol-2-yl)-4-{[(4E)-2-methyl[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]amino}phenol
Smiles: Cc1[nH]/c(=N/c2ccc(c(c2)c2nc3c(s2)cccc3)O)/c2c(n1)c1ccccc1o2

STK568148
Synonyms: 4-(2-chlorophenyl)-5-(4-chlorophenyl)-3-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: Clc1ccc(cc1)N1C(=O)c2c(C1c1ccccc1Cl)c([nH]n2)c1ccccc1

STK568149
Synonyms: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-]

STK568150
Synonyms: (5Z)-5-({[2-(dimethylammonio)ethyl]amino}methylidene)-1-(3,5-dimethylphenyl)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: Cc1cc(C)cc(c1)N1C(=NC(=O)/C(=C/NCC[NH+](C)C)/C1=O)[S-]

STK568151
Synonyms: (E)-(4-butoxyphenyl){1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CC[NH+](C)C)/[O-]

STK568153
Synonyms: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2,4-dichlorophenyl)-6-iodoquinazolin-4(3H)-one
Smiles: Clc1ccc(c(c1)Cl)n1c(/C=C/c2ccc3c(c2)OCO3)nc2c(c1=O)cc(cc2)I

STK568155
Synonyms: (E)-{2-(4-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Smiles: COc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/[O-]

STK568156
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)OCc1ccccc1

STK568157
Synonyms: N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCc1n[nH]/c(=N/C(=O)c2csc3c2CCC(C3)C)/s1

STK568159
Synonyms: 3-[(3-bromobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2cccc(c2)Br)nnc1c1cccc(c1)C

STK568160
Synonyms: 3-(2-nitrophenyl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1[N+](=O)[O-]

STK568161
Synonyms: 4-methoxy-N-[(2Z)-3-{[3-(trifluoromethyl)phenyl]amino}quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)C(F)(F)F

STK568162
Synonyms: 3-(2-chloro-5-nitrophenyl)-2,5-diphenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Clc1ccc(cc1C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1ccccc1)[N+](=O)[O-]

STK568163
Synonyms: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1c1ccncc1

STK568164
Synonyms: (3S,3a'R,8a'S,8b'S)-1-ethyl-2'-(2-methyl-3-nitrophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCN1c2ccccc2[C@@]2(C1=O)N1CCC[C@H]1[C@@H]1[C@H]2C(=O)N(C1=O)c1cccc(c1C)[N+](=O)[O-]

STK568165
Synonyms: (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(2E)-4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]prop-2-enamide
Smiles: COc1ccc(cc1Br)c1cs/c(=N/C(=O)/C=C/c2cc(Br)ccc2OC)/[nH]1

STK568167
Synonyms: (5E)-3-benzyl-6-hydroxy-5-{1-[(1-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CC(c1ccccc1)N/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/C

STK568168
Synonyms: N-[(3Z)-6-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]thiophene-2-carboxamide
Smiles: CCCn1[nH]/c(=N\C(=O)c2cccs2)/c2c1nc1ccc(cc1c2)C

STK568169
Synonyms: N-tert-butyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(N(C(C)(C)C)Cc1cc2ccccc2[nH]c1=O)C1CCCCC1

STK568170
Synonyms: 4-[(1E)-1-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)propyl]phenolate
Smiles: CC/C(=N\NC(=O)c1nnn(c1CSc1ccc(cc1)Cl)c1nonc1[NH3+])/c1ccc(cc1)[O-]

STK568171
Synonyms: (E)-[2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][4-(2-methylpropoxy)phenyl]methanolate
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCC(C)C)/[O-]

STK568172
Synonyms: 6-(3-methylpiperidin-1-yl)-5-nitro-N~2~-(tetrahydrofuran-2-ylmethyl)pyrimidine-2,4-diamine
Smiles: CC1CCCN(C1)c1nc(NCC2CCCO2)nc(c1[N+](=O)[O-])N

STK568173
Synonyms: 3-[(2,6-dichlorobenzyl)sulfanyl]-5-phenyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(SCc2c(Cl)cccc2Cl)nnc1c1ccccc1

STK568174
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-hexyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCCCN1C(=O)N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)C)C)/C1=O)O

STK568175
Synonyms: 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

STK568176
Synonyms: 2-(4-methoxyphenyl)-N-[(3Z)-8-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=c/1\[nH]n(c2c1cc1cccc(c1n2)C)CC(C)C

STK568177
Synonyms: N-[(3Z)-1,8-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)/N=c/1\[nH]n(c2c1cc1cccc(c1n2)C)C

STK568178
Synonyms: N-[(2E)-5-(2-methoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-phenoxyacetamide
Smiles: COc1ccccc1c1n[nH]/c(=N\C(=O)COc2ccccc2)/s1

STK568179
Synonyms: N-(2,4-dihydroxypyrimidin-5-yl)-2-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1CC(=O)Nc1cnc(nc1O)O

STK568181
Synonyms: 4-{[(E)-(2-chlorophenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccccc1Cl)c1[nH]nc2c1CCC2

STK568182
Synonyms: 2-({5-[(1S)-1-amino-2-(1H-indol-3-yl)ethyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(o1)[C@H](Cc1c[nH]c2c1cccc2)N)CC

STK568183
Synonyms: (5E)-5-[1-(2,3-dihydro-1H-inden-5-ylamino)propylidene]-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2ccc3c(c2)CCC3)/CC)/C1=O)O

STK568184
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(1E)-1-(4-propoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)/C

STK568186
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1OC)OC

STK568187
Synonyms: 1-(3-chlorophenyl)-3-(4-hydroxy-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)guanidine
Smiles: N=C(Nc1cccc(c1)Cl)Nc1nc(O)c2c(n1)CCC2

STK568189
Synonyms: 6-chloro-2-[(4-nitrobenzyl)sulfanyl]-3H-imidazo[4,5-b]pyridine
Smiles: Clc1cnc2c(c1)nc([nH]2)SCc1ccc(cc1)[N+](=O)[O-]

STK568191
Synonyms: 2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1ccccc1C(=O)[O-]

STK568193
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C

STK568194
Synonyms: 5-{(Z)-[3-(2-chlorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-6-(thiomorpholin-4-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccccc2Cl)c(n(c1=O)C)N1CCSCC1

STK568196
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)OC)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK568198
Synonyms: (5E)-6-hydroxy-5-{1-[(2-hydroxyethyl)amino]propylidene}-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/CC

STK568199
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK568200
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(5-methoxy-2-methyl-4-nitrophenyl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1cc(c(cc1[N+](=O)[O-])C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1ccc(c2C)C

STK568201
Synonyms: methylN-{(E)-[1-(4-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)O

STK568202
Synonyms: 2-[({1-[2-(piperidinium-1-yl)ethyl]-1H-benzimidazol-2-yl}amino)methyl]phenolate
Smiles: [O-]c1ccccc1CNc1nc2c(n1CC[NH+]1CCCCC1)cccc2

STK568203
Synonyms: methyl2-({[(4-bromo-1-methyl-1H-pyrazol-3-yl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2nn(cc2Br)C)sc2c1CCCCCC2

STK568204
Synonyms: N-[(2Z)-3-[(4-methoxyphenyl)amino]quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: COc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C

STK568205
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STK568206
Synonyms: methyl1-[(3Z)-3-{[(4-chlorophenyl)sulfonyl]imino}-1-hydroxy-4-oxo-3,4-dihydronaphthalen-2-yl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)C1=C(O)c2c(C(=O)/C/1=N\S(=O)(=O)c1ccc(cc1)Cl)cccc2

STK568207
Synonyms: methyl3-{[(3,4-dimethoxyphenyl)sulfonyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(c(c1)OC)OC)cc(cc2)F

STK568208
Synonyms: 3-heptyl-2-methyl-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C

STK568209
Synonyms: 1-ethoxy-4-hydroxy-3-phenylpyrrolo[1,2-a]quinoxaline-2-carboxamide
Smiles: CCOc1n2c(c(c1C(=O)N)c1ccccc1)c(O)nc1c2cccc1

STK568210
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(c(c2)O)O)nnc1c1ccc(cc1)C(C)(C)C

STK568211
Synonyms: 4-[4-(2-fluorophenyl)piperazin-1-yl]-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2ccccc2F)/s1)C

STK568212
Synonyms: (3'E)-3'-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1'-(3-methoxypropyl)-1-propylspiro[indole-3,2'-pyrrolidine]-2,4',5'(1H)-trione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C21C(=O)N(c1c2cccc1)CCC

STK568213
Synonyms: ethyl[(5Z)-5-({[(4-methylphenyl)sulfanyl]acetyl}imino)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N/C(=O)CSc2ccc(cc2)C)/s1

STK568214
Synonyms: 5-(3-ethoxyphenyl)-4-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(O)ccc2c1cccc2

STK568215
Synonyms: 2-amino-4-(2-chloro-5-nitrophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cc(ccc1Cl)[N+](=O)[O-])CCCCC2

STK568216
Synonyms: (E)-{2-[4-(dimethylamino)phenyl]-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene}{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Smiles: CN(c1ccc(cc1)C1/C(=C(/c2ccc(cc2)OCc2ccccc2C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1)C

STK568217
Synonyms: 3,4-dimethoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2ccc(cc2[nH]c1=O)C

STK568218
Synonyms: 7-butyl-6-hydroxy-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: CCCCn1c(N/N=C/c2ccncc2)nc2c1c(O)nc(=O)n2C

STK568219
Synonyms: N-(biphenyl-2-yl)-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)Nc1ccccc1c1ccccc1

STK568221
Synonyms: N-(4-butylphenyl)-N'-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: CCCCc1ccc(cc1)NC(=O)CCC(=O)/N=c\1/[nH]nc(s1)C1CCCCC1

STK568224
Synonyms: N-{(E)-[1-(3-bromophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}glycylglycine
Smiles: O=C(NCC(=O)O)CN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)Br)S

STK568225
Synonyms: (2E)-3-(furan-2-yl)-N-(5-oxo-7-phenyl-3,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)prop-2-enamide
Smiles: O=C(Nc1nn2c(=NC(=O)CC2c2ccccc2)[nH]1)/C=C/c1ccco1

STK568226
Synonyms: (5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-3-(4-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCc2ccc3c(c2)OCO3)/C)/C1=O)O

STK568228
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)cccc2

STK568229
Synonyms: methyl6'-amino-1-benzyl-2-oxo-3'-phenyl-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)Cc1ccccc1)c([nH]n2)c1ccccc1

STK568230
Synonyms: (5E)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=NC(=O)/C(=C\c2cc(n(c2C)C2CCCCC2)C)/C1=O)S

STK568232
Synonyms: 2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK568233
Synonyms: {(3Z)-3-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylammonio)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetate
Smiles: C[NH+](Cc1c(nnn1c1nonc1N)C(=O)N/N=C\1/c2ccccc2N(C1=O)CC(=O)[O-])C

STK568235
Synonyms: 4-[(E)-{(2E)-[4-(2,4-dichlorophenyl)-1,3-thiazol-2(3H)-ylidene]hydrazinylidene}methyl]phenyl2,4-dichlorobenzoate
Smiles: Clc1ccc(c(c1)Cl)C(=O)Oc1ccc(cc1)/C=N/N=c\1/scc([nH]1)c1ccc(cc1Cl)Cl

STK568236
Synonyms: ethyl4-hydroxy-1-(4-methylphenyl)-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C

STK568237
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

STK568238
Synonyms: 3-[5-(3-nitrophenyl)-1,2,4-oxadiazol-3-yl]quinolin-2(1H)-one
Smiles: [O-][N+](=O)c1cccc(c1)c1onc(n1)c1cc2ccccc2[nH]c1=O

STK568239
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK568240
Synonyms: 4-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1O

STK568241
Synonyms: (4E)-5-(4-chlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK568242
Synonyms: (5E)-1-(1,3-benzodioxol-5-yl)-2-hydroxy-5-[(1-methyl-1H-indol-3-yl)methylidene]pyrimidine-4,6(1H,5H)-dione
Smiles: OC1=NC(=O)/C(=C\c2cn(c3c2cccc3)C)/C(=O)N1c1ccc2c(c1)OCO2

STK568243
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-phenoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CCc1ccccc1)/c1ccc2c(c1)OCCO2

STK568244
Synonyms: 4-[(E)-{(2E)-[4-(2,4-dichlorophenyl)-1,3-thiazol-2(3H)-ylidene]hydrazinylidene}methyl]-2-ethoxyphenyl3-chlorobenzoate
Smiles: CCOc1cc(/C=N/N=c\2/scc([nH]2)c2ccc(cc2Cl)Cl)ccc1OC(=O)c1cccc(c1)Cl

STK568245
Synonyms: 4-methoxy-N-[(2Z)-3-[(3-methoxyphenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)OC

STK568246
Synonyms: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(3-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK568247
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-[4-(pentyloxy)phenyl]pyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC

STK568248
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O

STK568249
Synonyms: (6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl3-methylbenzoate
Smiles: Cc1cccc(c1)C(=O)OCc1cc2cc(C)ccc2[nH]c1=O

STK568250
Synonyms: (3S,3a'R,8a'S,8b'S)-5-methoxy-2'-(2-methyl-4-nitrophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-]

STK568251
Synonyms: 4,4',4'',4'''-porphyrin-5,10,15,20-tetrayltetrabenzenesulfonicacid
Smiles: OS(=O)(=O)c1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1ccc(cc1)S(=O)(=O)O)/C=C3)\c1ccc(cc1)S(=O)(=O)O)/[nH]2)/c1ccc(cc1)S(=O)(=O)O

STK568252
Synonyms: 8-[(2E)-2-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)hydrazinyl]-6-hydroxy-3,7-dimethyl-3,7-dihydro-2H-purin-2-one
Smiles: OC1=NC(=O)/C(=N/Nc2nc3c(n2C)c(O)nc(=O)n3C)/C(=N1)O

STK568253
Synonyms: 2-{4-[6-amino-5-cyano-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenoxy}acetamide
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OCC(=O)N)c([nH]n2)c1cccc(c1)OC

STK568254
Synonyms: 6-amino-3-(3-methoxyphenyl)-4-(naphthalen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc3c(c1)cccc3)c([nH]n2)c1cccc(c1)OC

STK568255
Synonyms: N-[(2E)-4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-2-(2-chlorophenoxy)acetamide
Smiles: COc1ccc(cc1Br)c1cs/c(=N/C(=O)COc2ccccc2Cl)/[nH]1

STK568257
Synonyms: N-[(3Z)-6-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]propanamide
Smiles: CCC(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)CC(C)C

STK568258
Synonyms: (5E)-5-({[2-(morpholin-4-ium-4-yl)ethyl]amino}methylidene)-4,6-dioxo-1-(3,4,5-trimethoxyphenyl)-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: COc1c(OC)cc(cc1OC)N1C(=NC(=O)/C(=C\NCC[NH+]2CCOCC2)/C1=O)[S-]

STK568260
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(cc1)F

STK568261
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-[4-(propan-2-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/O)C

STK568262
Synonyms: 3-(6-chloro-4-phenylquinolin-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylidene]aniline
Smiles: Clc1ccc2c(c1)c(cc(n2)c1cccc(c1)/N=C/c1ccc(o1)[N+](=O)[O-])c1ccccc1

STK568265
Synonyms: 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-methyl-4-(2-propoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: CCCOc1ccccc1C1SCC(=Nc2c1c(C)nn2C1CCOC(C1)(C)C)O

STK568267
Synonyms: prop-2-en-1-yl2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-4,5-dioxo-2-(3-phenoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(c2cccc(c2)Oc2ccccc2)/C(=C(/c2ccc(c(c2)C)OCc2ccccc2)\O)/C(=O)C1=O

STK568268
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCC3

STK568270
Synonyms: (5E)-1-(4-methoxyphenyl)-2,6-dioxo-5-(1-{[2-(piperidinium-1-yl)ethyl]amino}ethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCC[NH+]2CCCCC2)/C)/C1=O)[O-]

STK568271
Synonyms: 6-iodo-3-(4-nitrophenyl)-2-[(Z)-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: CCCN1c2ccccc2/C(=C/c2nc3ccc(cc3c(=O)n2c2ccc(cc2)[N+](=O)[O-])I)/C1=O

STK568273
Synonyms: (3S,3a'R,8a'S,8b'S)-6-chloro-7-methyl-2'-(4-methyl-3-nitrophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc(c(c2)[N+](=O)[O-])C)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1ccc(c2C)Cl

STK568274
Synonyms: 6-amino-3-(4-ethoxy-3-methoxyphenyl)-4-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccc(cc1OC)c1[nH]nc2c1C(c1cccc(c1)OC)C(=C(O2)N)C#N

STK568275
Synonyms: 2-chloro-N'-[(1Z)-1-(4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)propyl]benzohydrazide
Smiles: CC/C(=C\1/C(=O)NC(=O)N=C1O)/NNC(=O)c1ccccc1Cl

STK568276
Synonyms: N-[(3Z)-1-butyl-6-methoxy-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]thiophene-2-carboxamide
Smiles: CCCCn1[nH]/c(=N\C(=O)c2cccs2)/c2c1nc1ccc(cc1c2)OC

STK568277
Synonyms: N-[(2Z)-3-(butylamino)quinoxalin-2(1H)-ylidene]-2,5-dichlorobenzenesulfonamide
Smiles: CCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cc(Cl)ccc1Cl

STK568278
Synonyms: methyl[(5E)-5-{[(2-chlorophenyl)carbonyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetate
Smiles: COC(=O)Cc1n[nH]/c(=N\C(=O)c2ccccc2Cl)/s1

STK568279
Synonyms: ethyl4-(9-methyl-4-oxo-3-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCc1ccccc1

STK568280
Synonyms: (8E)-1-(2-chlorobenzyl)-3,7-dimethyl-8-[(2E)-(pyridin-3-ylmethylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(=O)c2n(C)/c(=N/N=C/c3cccnc3)/[nH]c2n(c1=O)C

STK568281
Synonyms: (5Z)-1-cyclopropyl-5-{[(1-phenylethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CC(c1ccccc1)N/C=C\1/C(=O)N=C(N(C1=O)C1CC1)S

STK568283
Synonyms: (5E)-5-({[(5-hydroxy-1,3,3-trimethylcyclohexyl)methyl]amino}methylidene)-1-(prop-2-en-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: C=CCN1C(=NC(=O)/C(=C\NCC2(C)CC(O)CC(C2)(C)C)/C1=O)S

STK568284
Synonyms: N-(2-tert-butylphenyl)-2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccccc1C(C)(C)C

STK568285
Synonyms: 4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-ylN-[(benzyloxy)carbonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)NC(=O)OCc1ccccc1

STK568286
Synonyms: N~2~-benzyl-6-(4-benzylpiperazin-1-yl)-N~2~-methyl-5-nitropyrimidine-2,4-diamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1N1CCN(CC1)Cc1ccccc1)N(Cc1ccccc1)C

STK568288
Synonyms: (4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STK568289
Synonyms: (4E)-1-benzyl-5-[4-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)OCc1ccccc1)Cc1ccccc1)/c1ccc2c(c1)OCCO2

STK568290
Synonyms: 4-bromo-2-[(E)-(2-{[(diphenylacetyl)amino]acetyl}hydrazinylidene)methyl]phenyl(2E)-3-(furan-2-yl)prop-2-enoate(non-preferredname)
Smiles: O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cc(Br)ccc1OC(=O)/C=C/c1ccco1

STK568291
Synonyms: (5E)-5-{[(2-ammoniophenyl)amino]methylidene}-1-[2-(cyclohex-1-en-1-yl)ethyl]-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C\Nc2ccccc2[NH3+])/C(=O)N1CCC1=CCCCC1

STK568292
Synonyms: [1-(3,4-dimethoxybenzyl)piperidin-3-yl](piperidin-1-yl)methanone
Smiles: COc1cc(ccc1OC)CN1CCCC(C1)C(=O)N1CCCCC1

STK568293
Synonyms: (5E)-5-(1-{[4-(diethylamino)phenyl]amino}propylidene)-6-hydroxy-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O)/CC)CC

STK568294
Synonyms: N-(2,6-dibromo-4-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(Br)cc(cc2Br)C)nnc1c1cccc(c1)C

STK568295
Synonyms: (1S)-2-methyl-1-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)propan-1-amine
Smiles: CC([C@@H](c1nnc(o1)SC/C=C/c1ccccc1)N)C

STK568296
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(furan-2-yl)methanolate
Smiles: C[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccco2)/[O-])/C1c1ccco1)C

STK568298
Synonyms: [(5Z)-5-({3-[3-(diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: CCN(S(=O)(=O)c1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(=O)O)c1ccccc1)CC

STK568299
Synonyms: 7-(4-chlorobenzyl)-6-hydroxy-3-methyl-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccc(cc1)Cn1c(N/N=C/c2cccnc2)nc2c1c(O)nc(=O)n2C

STK568300
Synonyms: 7'-chloro-2'-[(2,5-dimethoxyphenyl)carbonyl]-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)C1C(C(=O)c2ccccc2)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl)OC

STK568301
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(4-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK568302
Synonyms: N-(4-ethylphenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK568303
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-ethoxy-4-(pentyloxy)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK568304
Synonyms: (5E)-3-benzyl-5-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O

STK568307
Synonyms: (5Z)-3-(4-fluorophenyl)-6-hydroxy-5-[(octan-2-ylamino)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: CCCCCCC(N/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)F)O)C

STK568309
Synonyms: (5Z)-3-tert-butyl-5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/Nc2ccc3c(c2)CCC3)/C(=O)N1C(C)(C)C

STK568310
Synonyms: 2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)N/N=C/c1cc(Br)ccc1O

STK568312
Synonyms: 3-(4-chlorophenyl)-8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-oxo-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)Cl

STK568313
Synonyms: 7-(4-chlorobenzyl)-8-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2)N(C)C)nc2c1c(O)nc(=O)n2C

STK568314
Synonyms: 6'-amino-2-oxo-3'-propyl-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: CCCc1[nH]nc2c1C1(C(=O)Nc3c1cccc3)C(=C(O2)N)C#N

STK568315
Synonyms: 2-[(E)-2-(1-benzyl-2-methyl-1H-indol-3-yl)ethenyl]-6-iodo-3-(2-nitrophenyl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1c2ccccc2n(c1C)Cc1ccccc1)c1ccccc1[N+](=O)[O-]

STK568316
Synonyms: (E)-{2-(2,4-dimethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: COc1cc(OC)ccc1C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-]

STK568319
Synonyms: N-[(2Z)-3-[(4-fluorobenzyl)amino]quinoxalin-2(1H)-ylidene]-3-methylbenzenesulfonamide
Smiles: Fc1ccc(cc1)CNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)C

STK568320
Synonyms: 4-({2-oxo-2'-[(4-pentylphenyl)carbonyl]-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-1'-yl}carbonyl)phenylacetate
Smiles: CCCCCc1ccc(cc1)C(=O)C1C(C(=O)c2ccc(cc2)OC(=O)C)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK568321
Synonyms: N-[(2S)-1-[(4-bromo-3-methylphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(c(c1)C)Br)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK568322
Synonyms: ethyl[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)sulfanyl]acetate
Smiles: [O-][N+](=O)c1c(SCC(=O)OCC)cc(c2c1non2)Cl

STK568323
Synonyms: 2'-(2-ethoxyphenyl)-7'-fluoro-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1C1C(C(=O)c2cccc(c2)OC)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F

STK568324
Synonyms: 8-(hexylamino)-6-hydroxy-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(NCCCCCC)nc2c1c(O)nc(=O)n2C

STK568325
Synonyms: 6-amino-4-(2,4-dimethoxyphenyl)-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COc1ccc(c(c1)OC)C1C(=C(N)Oc2c1c([nH]n2)c1cccc(c1)OC)C#N

STK568326
Synonyms: 5-(4-fluorophenyl)-3-(4-hydroxy-3-methoxyphenyl)-2-(4-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cc(ccc1O)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)c1ccc(cc1)[N+](=O)[O-]

STK568328
Synonyms: (4E)-5-(4-bromophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK568329
Synonyms: 2-[(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)sulfanyl]-N-cyclohexylacetamide
Smiles: O=C(NC1CCCCC1)CSc1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK568330
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(dimethylammonio)propyl]-2-[3-ethoxy-4-(pentyloxy)phenyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STK568331
Synonyms: 2-(3,4-dimethoxyphenyl)-14-phenyl-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1OC)c1nc2n(n1)cnc1c2C(c2ccccc2)c2c(O1)c1ccccc1cc2

STK568332
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-dimethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2OC)OC)nnc1COc1ccc(cc1)Cl

STK568333
Synonyms: N-[5-(acetylamino)-2-methoxyphenyl]-2-{[5-phenyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(ccc2OC)NC(=O)C)nnc1c1ccccc1

STK568335
Synonyms: 2'-[(4-methoxyphenyl)carbonyl]-5',7'-dimethyl-1'-[(4-methylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)C1C(C(=O)c2ccc(cc2)C)N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2ccc(c1)C)C

STK568337
Synonyms: N-(4-ethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OCC)c1cccc(c1)C

STK568338
Synonyms: 9,9-dimethyl-9a-[(E)-2-(2-nitrophenyl)ethenyl]-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: O=C1CN2C(N1)(/C=C/c1ccccc1[N+](=O)[O-])C(c1c2cccc1)(C)C

STK568339
Synonyms: 8-(4-benzylpiperazin-1-yl)-7-ethyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1

STK568340
Synonyms: 12-(pyridin-4-yl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccncc2)c2ccccc2n3)CCC1

STK568341
Synonyms: 7'-chloro-1'-(2,2-dimethylpropanoyl)-2'-[(4-propylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)C1C(N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl)C(=O)C(C)(C)C

STK568342
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK568343
Synonyms: 4-methoxy-N-[(2Z)-3-{[2-(4-methoxyphenyl)ethyl]amino}quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: COc1ccc(cc1)CCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)OC

STK568344
Synonyms: N-[(2Z)-3-(butylamino)quinoxalin-2(1H)-ylidene]-3-chlorobenzenesulfonamide
Smiles: CCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)Cl

STK568346
Synonyms: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C

STK568347
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1[NH3+]

STK568348
Synonyms: N-[(2Z)-3-[(3-fluoro-4-methylphenyl)amino]quinoxalin-2(1H)-ylidene]thiophene-2-sulfonamide
Smiles: Cc1ccc(cc1F)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccs1

STK568349
Synonyms: methylN-[(1-benzylpiperidin-4-yl)carbamoyl]-L-methioninate
Smiles: COC(=O)[C@@H](NC(=O)NC1CCN(CC1)Cc1ccccc1)CCSC

STK568350
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK568351
Synonyms: 5-(4-fluorophenyl)-4-({(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK568352
Synonyms: (4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STK568353
Synonyms: 5-chloro-7-methyl-2'-(2-methyl-4-nitrophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1cc(C)c2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-]

STK568354
Synonyms: N-[(2Z)-3-[(3-ethylphenyl)amino]quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
Smiles: CCc1cccc(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)F

STK568355
Synonyms: 2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1OC

STK568356
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK568357
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(E)-(3-propoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1cccc(c1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STK568359
Synonyms: (5Z)-5-[(benzylamino)methylidene]-2-sulfanyl-1-(2,4,6-trimethylphenyl)pyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=NC(=O)/C(=C/NCc2ccccc2)/C1=O)S

STK568361
Synonyms: 3'-(2,4-dichlorophenyl)-5'-(4-nitrophenyl)spiro[indene-2,4'-[1,2]oxazole]-1,3-dione
Smiles: Clc1ccc(c(c1)Cl)C1=NOC(C21C(=O)c1c(C2=O)cccc1)c1ccc(cc1)[N+](=O)[O-]

STK568362
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1cccc(c1)C(F)(F)F

STK568363
Synonyms: N-{(2S)-1-[(furan-2-ylmethyl)amino]-3-methyl-1-oxobutan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CC([C@@H](C(=O)NCc1ccco1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C

STK568364
Synonyms: N~2~-methyl-6-(morpholin-4-yl)-5-nitropyrimidine-2,4-diamine
Smiles: CNc1nc(N2CCOCC2)c(c(n1)N)[N+](=O)[O-]

STK568365
Synonyms: prop-2-en-1-yl2-{(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OCC=C

STK568366
Synonyms: N-(4-butylphenyl)-2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1cccc(c1)Cl

STK568368
Synonyms: 2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1c1ccccc1)c1ccccc1Cl

STK568370
Synonyms: N-tert-butyl-4-methoxy-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(C(C)(C)C)Cc1cc2ccccc2[nH]c1=O

STK568371
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1cccc(c1)Cl

STK568372
Synonyms: (5E)-6-hydroxy-5-{1-[(2-hydroxyethyl)amino]ethylidene}-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: OCCN/C(=C/1\C(=NC(=O)N(C1=O)CC=C)O)/C

STK568373
Synonyms: N-[(2Z)-3-[(2,4-dimethoxyphenyl)amino]quinoxalin-2(1H)-ylidene]thiophene-2-sulfonamide
Smiles: COc1cc(OC)ccc1Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccs1

STK568374
Synonyms: 2-chloro-4-(5-{(Z)-[1-(3-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Fc1cccc(c1)N1C(=NC(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)/C1=O)S

STK568375
Synonyms: 6-amino-4-(2-chlorophenyl)-3-(4-ethoxy-3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccc(cc1OC)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1ccccc1Cl

STK568376
Synonyms: 6-amino-4-(2,6-dichlorophenyl)-3-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1c(Cl)cccc1Cl

STK568377
Synonyms: N-[(3Z)-1,6-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)C

STK568378
Synonyms: 3-[5-(4-bromophenyl)furan-2-yl]-5-(4-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Brc1ccc(cc1)c1ccc(o1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK568379
Synonyms: (5Z)-5-({[2-(diethylammonio)ethyl]amino}methylidene)-1-(2,4-dimethylphenyl)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: CC[NH+](CCN/C=C\1/C(=O)N=C(N(C1=O)c1ccc(cc1C)C)[S-])CC

STK568380
Synonyms: 8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)OC

STK568382
Synonyms: 7-butyl-8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCn1c(N/N=C/c2ccccc2Cl)nc2c1c(O)nc(=O)n2C

STK568383
Synonyms: (4E)-5-(furan-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccco1

STK568385
Synonyms: ethyl[4-(dimethylamino)phenyl][(phenylamino)(3,4,5-trimethoxyphenyl)methyl]phosphinate
Smiles: CCOP(=O)(C(c1cc(OC)c(c(c1)OC)OC)Nc1ccccc1)c1ccc(cc1)N(C)C

STK568387
Synonyms: ethyl[4-(7-benzyl-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl)piperazin-1-yl]acetate
Smiles: CCOC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(O)nc(=O)n2C

STK568388
Synonyms: 2-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-5-hydroxy-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)N2CCN(CC2)Cc2ccccc2)N=C2C(=C(O)CCC2)C1c1ccc(cc1)C

STK568389
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(4-ethoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/O

STK568390
Synonyms: N-(2-methoxyphenyl)-1,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1OC)c1ccc(cc1)OC

STK568391
Synonyms: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(1-phenylethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C/NC(c2ccccc2)C)/C(=O)N1CCC1=CCCCC1

STK568392
Synonyms: methyl2-[(3E)-3-[hydroxy(4-methoxyphenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

STK568394
Synonyms: (4E)-1-benzyl-5-[4-(benzyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STK568396
Synonyms: N-[4-(acetylamino)phenyl]-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nnc1COc1ccc(cc1)C

STK568397
Synonyms: 2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK568398
Synonyms: 2-[(E)-(2-{[2-(4-ammonio-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]acetyl}hydrazinylidene)methyl]-4-bromophenolate
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1[NH3+])N/N=C/c1cc(Br)ccc1[O-]

STK568400
Synonyms: 3-(4,5-dimethoxy-2-nitrophenyl)-5-(3-methoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cccc(c1)N1C(=O)C2C(C1=O)ON(C2c1cc(OC)c(cc1[N+](=O)[O-])OC)c1ccccc1

STK568402
Synonyms: N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-N'-(4-fluorobenzyl)butanediamide
Smiles: O=C(NCc1ccc(cc1)F)CCC(=O)/N=c\1/[nH]nc(s1)C1CCCCC1

STK568403
Synonyms: 6-amino-3-[4-(benzyloxy)phenyl]-4-(5-methylthiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(s1)C)c([nH]n2)c1ccc(cc1)OCc1ccccc1

STK568404
Synonyms: 2-methoxy-4-{(E)-[2-(morpholin-4-ium-4-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}-6-nitrophenolate
Smiles: COc1cc(/C=C\2/SC(=NC2=O)[NH+]2CCOCC2)cc(c1[O-])[N+](=O)[O-]

STK568405
Synonyms: 4-fluoro-N-[(2Z)-3-(pentylamino)quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: CCCCCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)F

STK568406
Synonyms: (5Z)-1-benzyl-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)Cc1ccccc1)S

STK568407
Synonyms: 7-(thiophen-2-yl)-2-{[(2E)-4,6,7-trimethylquinazolin-2(1H)-ylidene]amino}-7,8-dihydroquinazolin-5(6H)-one
Smiles: O=C1CC(Cc2c1cnc(n2)/N=c\1/nc(C)c2c([nH]1)cc(c(c2)C)C)c1cccs1

STK568408
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2,6-dimethoxyphenolate
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(OC)c(c(c1)OC)[O-]

STK568410
Synonyms: 5-(5-methyl-1H-pyrazol-3-yl)-4-{[(E)-pyridin-3-ylmethylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1[nH]nc(c1)c1nnc(n1/N=C/c1cccnc1)S

STK568411
Synonyms: N-[(2Z)-5-[(4-bromophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)/N=c\1/[nH]nc(s1)COc1ccc(cc1)Br

STK568413
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-phenylpyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccccc2)/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C1=O

STK568414
Synonyms: 2'-(1,3-benzodioxol-5-ylcarbonyl)-7'-chloro-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Clc1ccc2c(c1)C=CC1N2C(C(=O)c2cccs2)C(C21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)OCO2

STK568416
Synonyms: (5E)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=NC1=O)O)O

STK568418
Synonyms: (4E)-5-[4-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)OCc1ccccc1

STK568419
Synonyms: 3-{(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(4-methoxyphenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccco1)C

STK568420
Synonyms: 3-(2,4-dichlorophenyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(c(c1)Cl)n1c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK568421
Synonyms: 10'-(2,4-dimethoxyphenyl)-11'-(phenylcarbonyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: COc1ccc(c(c1)OC)C1C(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1

STK568423
Synonyms: 6-hydroxy-8-[(2E)-2-(4-hydroxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(N/N=C/c2ccc(cc2)O)nc2c1c(O)nc(=O)n2C

STK568424
Synonyms: 2-bromo-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1ccccc1Br)Cc1cc2cccc(c2[nH]c1=O)C

STK568425
Synonyms: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O

STK568426
Synonyms: 5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN1C(=O)N(C)C(=O)C(=Cc2ccc3c(c2)CCCN3Cc2ccccc2)C1=O

STK568427
Synonyms: 2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenolate
Smiles: COc1cccc(c1[O-])/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1[NH3+]

STK568428
Synonyms: 4-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(propan-2-yl)benzamide
Smiles: Cc1ccc(cc1)C(=O)N(C(C)C)Cc1cc2cccc(c2[nH]c1=O)C

STK568430
Synonyms: 5,8-dimethyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1n2C)CCc1ccccc1

STK568431
Synonyms: N-(2-fluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccccc1F

STK568432
Synonyms: 4-[(1E)-1-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]-2-methoxyphenolate
Smiles: COc1cc(ccc1[O-])/C(=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1[NH3+])/C

STK568433
Synonyms: 7-phenyl-2-{[(2E)-4,6,7-trimethylquinazolin-2(1H)-ylidene]amino}-7,8-dihydroquinazolin-5(6H)-one
Smiles: O=C1CC(Cc2c1cnc(n2)/N=c\1/nc(C)c2c([nH]1)cc(c(c2)C)C)c1ccccc1

STK568434
Synonyms: 2-[(6-bromo-3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]-N-(2,4,6-tribromophenyl)acetamide
Smiles: O=C(Nc1c(Br)cc(cc1Br)Br)CSc1[nH]c2c(n1)cc(cn2)Br

STK568435
Synonyms: N'-[(1E,2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Br)nnc1c1ccc(cc1)C

STK568436
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK568437
Synonyms: (E)-[4-(dimethylsulfamoyl)phenyl]{2-(4-fluorophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Fc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)S(=O)(=O)N(C)C)/[O-]

STK568438
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2,6-di-tert-butylphenolate
Smiles: CCCc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)C

STK568439
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STK568441
Synonyms: (4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-methoxy-4-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STK568442
Synonyms: (2E)-2-[(4-chlorophenyl)imino]-N~4~-(4-fluorophenyl)-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: Fc1ccc(cc1)Nc1n/c(=N/c2ccc(cc2)Cl)/[nH]c(c1[N+](=O)[O-])N

STK568443
Synonyms: 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)C(c2ccc(cc2)Cl)c2ccccc2)/s1

STK568445
Synonyms: 3-amino-N'-[(E)-quinoxalin-6-ylmethylidene]propanehydrazide(non-preferredname)
Smiles: NCCC(=O)N/N=C/c1ccc2c(c1)nccn2

STK568446
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nnc1Cc1cccs1

STK568447
Synonyms: N,2-dimethyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CN(C(=O)c1ccccc1C)Cc1cc2ccccc2[nH]c1=O

STK568448
Synonyms: N-(4-{[(1E)-2-(2-chlorobenzyl)-4-cyano-3-methylpyrido[1,2-a]benzimidazol-1(5H)-ylidene]amino}phenyl)acetamide
Smiles: N#Cc1c(C)c(Cc2ccccc2Cl)/c(=N\c2ccc(cc2)NC(=O)C)/n2c1[nH]c1c2cccc1

STK568449
Synonyms: {(4E)-6-amino-4-[(4-ethoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-yl}methyl4-phenylpiperazine-1-carbodithioate
Smiles: CCOc1ccc(cc1)/N=c\1/nc(CSC(=S)N2CCN(CC2)c2ccccc2)nc([nH]1)N

STK568450
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1COc1ccc(cc1)Cl

STK568452
Synonyms: 4-fluoro-N-[(2Z)-3-[(2-fluorophenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccccc1F

STK568453
Synonyms: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(c(c2)OCC)O)/C(=C(/c2ccc(cc2)OC(C)C)\O)/C(=O)C1=O

STK568454
Synonyms: 4-[(E)-[2-(4-bromophenyl)-1-(2-methoxyethyl)-4,5-dioxopyrrolidin-3-ylidene](hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
Smiles: COCCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\O)/C(=O)C1=O

STK568455
Synonyms: Nalpha-({1-[N-(tert-butoxycarbonyl)-L-leucyl]piperidin-4-yl}carbonyl)-N-(2-fluorobenzyl)-L-phenylalaninamide
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccccc1F)Cc1ccccc1)NC(=O)OC(C)(C)C)C

STK568457
Synonyms: (4E)-1-benzyl-5-(4-butoxy-3-ethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

STK568458
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C

STK568459
Synonyms: N-[(3Z)-6-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3-nitrobenzamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2cccc(c2)[N+](=O)[O-])/c2c1nc1ccc(cc1c2)C)C

STK568460
Synonyms: methylN-[(4-acetylphenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(cc1)C(=O)C

STK568461
Synonyms: 5-(4-bromophenyl)-3-(4-butoxy-3-ethoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCCOc1ccc(cc1OCC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1

STK568462
Synonyms: (5Z)-3-benzyl-5-{1-[(2,5-dimethoxyphenyl)amino]ethylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(c(c1)N/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/C)OC

STK568465
Synonyms: (E)-{2-(4-bromophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: C[NH+](CCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C1=O)C

STK568467
Synonyms: 2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1OC

STK568468
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK568469
Synonyms: (5E)-5-{[(3-chloro-4-methoxyphenyl)amino]methylidene}-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\Nc2ccc(c(c2)Cl)OC)/C1=O)O

STK568470
Synonyms: (4E)-5-(4-tert-butylphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK568471
Synonyms: N-[3-(furan-2-yl)-4-phenylbutyl][1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: c1ccc(cc1)CC(c1ccco1)CCNc1ncnc2c1oc1c2cccc1

STK568472
Synonyms: 2,2-dimethyl-2',3',4',4a'-tetrahydro-1'H,6'H-spiro[1,3-dioxane-5,5'-pyrido[1,2-a]quinoline]-4,6-dione
Smiles: O=C1OC(C)(C)OC(=O)C21Cc1ccccc1N1C2CCCC1

STK568473
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cc(OC)c(c(c1)OC)OC)CC[NH+](C)C)/[O-]

STK568474
Synonyms: 3-[(3-chlorobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(SCc2cccc(c2)Cl)nnc1c1ccc(cc1)OC

STK568475
Synonyms: 2-{[7,7-dimethyl-5-oxo-4-(2-phenylethyl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N-methyl-N-phenylacetamide
Smiles: CN(c1ccccc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)(C)C

STK568476
Synonyms: N-(4-{[(1E)-1-(1-benzyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)ethyl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/C

STK568478
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nnc1COc1ccc(cc1)C

STK568480
Synonyms: 4-[5-(4-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenyl4-fluorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)F)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)c1ccccc1

STK568481
Synonyms: 3-(4-chloro-2-nitrophenyl)-6-iodo-2-[(Z)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])n1c(/C=C/2\C(=O)Nc3c2cccc3)nc2c(c1=O)cc(cc2)I

STK568482
Synonyms: 7-chloro-4-nitro-5-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-2,1,3-benzoxadiazole
Smiles: [O-][N+](=O)c1c(cc(c2c1non2)Cl)Sc1nnnn1c1ccccc1

STK568483
Synonyms: (5E)-5-(3-nitrobenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK568484
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(2-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1[N+](=O)[O-]

STK568486
Synonyms: 4-ethoxy-N-[(3Z)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CCOc1ccc(cc1)C(=O)/N=c/1\[nH]n(c2c1cc1ccc(cc1n2)C)CC

STK568488
Synonyms: 1'-[(4-chlorophenyl)carbonyl]-2'-(3,4-dimethoxyphenyl)-7'-fluoro-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1OC)C1C(C(=O)c2ccc(cc2)Cl)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)F

STK568489
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)[N+](=O)[O-])c2nonc2[NH3+])ccc1[O-]

STK568491
Synonyms: (4E)-5-[4-(benzyloxy)-3-methoxyphenyl]-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK568492
Synonyms: 5-(3-methylphenyl)-4-{[(E)-(4-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)[N+](=O)[O-]

STK568493
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenolate
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1ccc(c(c1)OCC)[O-]

STK568494
Synonyms: methyl[(2E)-5-(4-bromophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate
Smiles: COC(=O)/N=c/1\[nH]nc(s1)c1ccc(cc1)Br

STK568496
Synonyms: 3-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]-1-({3-[(1Z)-1-(3-methoxyphenyl)-1-(4-methoxyphenyl)but-1-en-2-yl]-1H-indol-1-yl}methyl)-1H-indole
Smiles: COc1ccc(cc1)/C(=C(\c1cn(c2c1cccc2)Cn1cc(c2c1cccc2)/C(=C(\c1cccc(c1)OC)/c1ccc(cc1)OC)/CC)/CC)/c1ccc(cc1)OC

STK568497
Synonyms: N-(4-butylphenyl)-2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl

STK568498
Synonyms: N-cyclohexyl-4-methoxy-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(C1CCCCC1)Cc1cc2cccc(c2[nH]c1=O)C

STK568499
Synonyms: 7-(4-chlorophenyl)-3-(3-nitrophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1cccc(c1)[N+](=O)[O-]

STK568500
Synonyms: N-[(3Z)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]butanamide
Smiles: CCCC(=O)/N=c/1\[nH]n(c2c1cc1ccc(cc1n2)C)CC

STK568501
Synonyms: (E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CC[NH+]1CCOCC1)/[O-])C

STK568502
Synonyms: 6-amino-3-(4-ethoxy-3-methoxyphenyl)-4-(2-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccc(cc1OC)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1ccccc1[N+](=O)[O-]

STK568503
Synonyms: (8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl3,4,5-triethoxybenzoate
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)OCc1cc2cccc(c2[nH]c1=O)C

STK568505
Synonyms: 3-{4-[(5Z)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/S1

STK568506
Synonyms: 2-[(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)sulfanyl]-3-(2-phenylethyl)quinazolin-4(3H)-one
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)Sc1nc2ccccc2c(=O)n1CCc1ccccc1

STK568507
Synonyms: (5E)-3-cyclohexyl-6-hydroxy-5-[(1-propyl-1H-indol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: CCCn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O

STK568508
Synonyms: N-[(2Z)-3-{[2-(4-methoxyphenyl)ethyl]amino}quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: COc1ccc(cc1)CCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C

STK568509
Synonyms: 6-amino-3-[4-(benzyloxy)phenyl]-4-(4-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)[N+](=O)[O-])c([nH]n2)c1ccc(cc1)OCc1ccccc1

STK568510
Synonyms: (4E)-5-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1cc(Br)c(c(c1)OC)O

STK568511
Synonyms: 4-(4-chlorophenyl)-3-[(2,4-dichlorobenzyl)sulfanyl]-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCc1ccc(cc1Cl)Cl

STK568512
Synonyms: 6-(5-bromo-2-methoxyphenyl)-7-(2-fluorophenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC1=C(C2c2ccccc2F)C(Oc2c1cccc2)c1cc(Br)ccc1OC

STK568513
Synonyms: N-[(2Z)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoxalin-2(1H)-ylidene]-2,5-dimethylbenzenesulfonamide
Smiles: Cc1ccc(c(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc2c(c1)OCCO2)C

STK568514
Synonyms: 2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)acetamide
Smiles: O=C(Nc1c(Br)cc(cc1Br)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK568515
Synonyms: 2-(4-fluorophenoxy)-N-[(2E)-5-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)/C=C/c1n[nH]/c(=N\C(=O)COc2ccc(cc2)F)/s1

STK568517
Synonyms: 3'-benzyl-5'-(2-methoxy-5-nitrophenyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COc1ccc(cc1N1C(=O)C2C(C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cccc2)[N+](=O)[O-]

STK568518
Synonyms: 2-[7-(4-fluorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1nnc2n1cnc1c2cnn1c1ccc(cc1)F

STK568519
Synonyms: (4E)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C

STK568520
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-(3-methylbutoxy)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1)C

STK568522
Synonyms: N-[(3Z)-6-methoxy-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2,2-dimethylpropanamide
Smiles: COc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N\C(=O)C(C)(C)C)CC(C)C

STK568523
Synonyms: 2-[({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1H-benzimidazole
Smiles: COc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1COc1ccc(cc1)C

STK568524
Synonyms: 2-(14-phenyl-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-2-yl)naphthalen-1-olate
Smiles: [O-]c1c2ccccc2ccc1c1nc2n([nH+]1)cnc1c2C(c2ccccc2)c2c(O1)c1ccccc1cc2

STK568525
Synonyms: N-[(2Z)-5-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-4-nitrobenzamide
Smiles: COc1ccc(cc1)/C=C/c1n[nH]/c(=N/C(=O)c2ccc(cc2)[N+](=O)[O-])/s1

STK568526
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1CC)c1cccc(c1)Cl

STK568527
Synonyms: N-[(4Z)-[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]-4-fluoroaniline
Smiles: Fc1ccc(cc1)/N=c/1\[nH]cnc2c1oc1c2cccc1

STK568528
Synonyms: 2-[({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1H-benzimidazole
Smiles: COc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1COc1ccc(cc1)Cl

STK568529
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-(5-methylfuran-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Cc1ccc(o1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK568530
Synonyms: N-[(2Z)-5-(2-ethoxyethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3,4,5-trimethoxybenzamide
Smiles: CCOCCc1n[nH]/c(=N/C(=O)c2cc(OC)c(c(c2)OC)OC)/s1

STK568532
Synonyms: 2-chloro-N-[(3Z)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CCCn1[nH]/c(=N\C(=O)c2ccccc2Cl)/c2c1nc1cc(C)ccc1c2

STK568534
Synonyms: N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)OCc2ccccc2)nc2c(c1=O)cccc2

STK568535
Synonyms: (2E)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(2-hydroxy-4-nitrobenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)N/N=C/c1ccc(cc1O)[N+](=O)[O-]

STK568536
Synonyms: methyl4-{(3E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK568540
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(4-fluorophenyl)carbonyl]-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)[N+](=O)[O-])N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK568542
Synonyms: 4-{[2'-(3-chlorophenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-1'-yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)C1N2c3ccccc3C=CC2C2(C1c1cccc(c1)Cl)C(=O)c1c(C2=O)cccc1

STK568543
Synonyms: 2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Smiles: CCCc1nc(SCC(=O)Nc2ccc(cc2)c2sc3c(n2)ccc(c3)C)nc(c1)O

STK568544
Synonyms: (5E)-1-(4-chlorophenyl)-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)Cl)S

STK568545
Synonyms: N-[(3Z)-1,7-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)/N=c/1\[nH]n(c2c1cc1ccc(cc1n2)C)C

STK568546
Synonyms: (8S,8aR,11aS)-8-(1,3-benzodioxol-5-ylcarbonyl)-10-(2-methyl-4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C([C@@H]1[C@H]2[C@@H](C3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])c1ccc2c(c1)OCO2

STK568547
Synonyms: N-[(2Z)-3-(1,3-benzodioxol-5-ylamino)quinoxalin-2(1H)-ylidene]-3-chlorobenzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc2c(c1)OCO2

STK568550
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(5-methoxy-2-methyl-4-nitrophenyl)-7-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1cc(c(cc1[N+](=O)[O-])C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2C

STK568551
Synonyms: 8-[(diethylammonio)methyl]-2-methyl-4-oxo-3-[4-(propoxycarbonyl)phenoxy]-4H-chromen-7-olate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+](CC)CC)[O-]

STK568553
Synonyms: 1-(3,4-dihydroxyphenyl)-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)c1ccc(c(c1)O)O

STK568554
Synonyms: 3,4-dichloro-N-[(2E)-5-(4-methoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccc(cc1)Cc1n[nH]/c(=N\C(=O)c2ccc(c(c2)Cl)Cl)/s1

STK568555
Synonyms: (2E)-2-cyano-2-[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3,5-dimethylphenyl)ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(c(c2)OC)OC)/c(=O)n1c1ccccc1)/C(=O)Nc1cc(C)cc(c1)C

STK568557
Synonyms: (2E)-2-cyano-2-[(5E)-5-(3-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-phenylethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2cccc(c2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)Nc1ccccc1

STK568558
Synonyms: methyl4-[2-amino-3-(heptylcarbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoate
Smiles: CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)OC

STK568559
Synonyms: N-[(2Z)-3-(cyclohexylamino)quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NC1CCCCC1

STK568561
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-furan-2-ylmethylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN(c1ccccc1)C)c1nonc1N)N/N=C/c1ccco1

STK568562
Synonyms: 4-[3-(3,4-dimethoxyphenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]phenylacetate
Smiles: COc1cc(ccc1OC)C1=NOC2C1C(=O)N(C2=O)c1ccc(cc1)OC(=O)C

STK568563
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-(2-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=S)NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O

STK568564
Synonyms: N-{1-(2-methoxyethyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-4-methylbenzenesulfonamide
Smiles: COCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)C)S(=O)(=O)c1ccc(cc1)C

STK568565
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

STK568566
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)OCc2ccccc2)nnc1c1cccc(c1)C

STK568567
Synonyms: methylN-{[2-(4-fluorophenyl)ethyl]carbamoyl}-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)NCCc1ccc(cc1)F

STK568568
Synonyms: 6-chloro-2-hydroxy-4-phenylquinolin-3-ylpiperidine-1-carbodithioate
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)SC(=S)N1CCCCC1

STK568569
Synonyms: ethyl2-{(3E)-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(=O)OC)/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C1=O

STK568570
Synonyms: 2-[4-(2-bromo-4-chlorophenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccc(cc2Br)Cl)c2c(n1)cccc2

STK568571
Synonyms: 3-(4-chloro-2-nitrophenyl)-6-iodo-2-[(E)-2-(4-methoxyphenyl)ethenyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1ccc(cc1[N+](=O)[O-])Cl)I

STK568572
Synonyms: (4E)-5-(4-hydroxy-3-methoxyphenyl)-4-{hydroxy[4-(piperidin-1-ylsulfonyl)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)S(=O)(=O)N2CCCCC2)/O)/C1c1ccc(c(c1)OC)O

STK568573
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK568574
Synonyms: 4-{[(E)-(2-nitrophenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1ccccc1[N+](=O)[O-])c1[nH]nc2c1CCC2

STK568576
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-N'-[(E)-pyridin-3-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1cccnc1

STK568577
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1cccc(c1)OCCC(C)C

STK568578
Synonyms: 4-[(E)-{(2E)-[4-(2,4-dichlorophenyl)-1,3-thiazol-2(3H)-ylidene]hydrazinylidene}methyl]-2-ethoxyphenyl4-tert-butylbenzoate
Smiles: CCOc1cc(/C=N/N=c\2/scc([nH]2)c2ccc(cc2Cl)Cl)ccc1OC(=O)c1ccc(cc1)C(C)(C)C

STK568580
Synonyms: ethyl4-{(3E)-2-(4-bromophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(cc1)Br

STK568581
Synonyms: (E)-{1'-[3-(dimethylammonio)propyl]-1-methyl-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C21C(=O)N(c1c2cccc1)C)CCC[NH+](C)C)/[O-]

STK568582
Synonyms: (4E)-5-[4-(benzyloxy)phenyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2ccc(cc2)OCc2ccccc2)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)/O

STK568583
Synonyms: 2-[(E)-(2-{[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoicacid
Smiles: O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)N/N=C/c1ccccc1C(=O)O

STK568584
Synonyms: (5E)-5-({[2-(morpholin-4-ium-4-yl)ethyl]amino}methylidene)-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C\NCC[NH+]2CCOCC2)/C(=O)N1CCc1ccccc1

STK568585
Synonyms: 2-chloro-N-[1-(4-fluorophenyl)-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=O)C2(NC(=O)c1ccccc1Cl)C(F)(F)F)O

STK568586
Synonyms: 2-oxo-N-[(2E)-6-(pyrrolidin-1-ylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-2H-chromene-3-carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCCC1

STK568587
Synonyms: 2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)N

STK568588
Synonyms: 6'-amino-3'-(methoxymethyl)-5-nitro-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: COCc1[nH]nc2c1C1(C(=O)Nc3c1cc(cc3)[N+](=O)[O-])C(=C(O2)N)C#N