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STK589195
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,5-dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2Cl)N=C2C(=C(O)CCC2)C1c1ccco1

STK589196
Synonyms: 7-(4-chlorobenzyl)-1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK589198
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-2-[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c1c2cccc1)NCCCn1cncc1

STK589199
Synonyms: (3a'S,6a'R)-5'-(4-bromophenyl)-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Brc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

STK589200
Synonyms: (4Z)-4-[(3-chloro-4-methylphenyl)imino]-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccc(c(c2)Cl)C)/[nH]1

STK589202
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,3-dimethylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1C)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK589203
Synonyms: (3a'S,6a'R)-5-fluoro-5'-(4-fluorophenyl)-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)F)Cc1ccc(cc1)O)C(=O)N2

STK589204
Synonyms: 5-decyl-2,6-dimethylpyrimidin-4-ol
Smiles: CCCCCCCCCCc1c(C)nc(nc1O)C

STK589205
Synonyms: 2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK589207
Synonyms: 3-chloro-N-[(2Z)-3-{[2-(morpholin-4-yl)ethyl]amino}quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCCN1CCOCC1

STK589209
Synonyms: 2-chloro-4-(5-{(E)-[1-(2-fluorobenzyl)-2-hydroxy-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: OC1=N/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)/C(=O)N1Cc1ccccc1F

STK589210
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-3-(naphthalen-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2nc3c([nH]2)cccc3)/C(=O)N1c1ccc2c(c1)cccc2

STK589211
Synonyms: 2-{4-[6-hydroxy-3-methyl-7-(3-methylbutyl)-2-oxo-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: CC(CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)CC(=O)N)C

STK589212
Synonyms: (3a'S,6a'R)-7-chloro-3'-(3,4-dihydroxybenzyl)-5'-(4-fluorobenzyl)-5-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(C)cc2Cl

STK589213
Synonyms: 6-nitro-1-(5-oxohexyl)-3,4-dihydroquinolin-2(1H)-one
Smiles: CC(=O)CCCCN1C(=O)CCc2c1ccc(c2)[N+](=O)[O-]

STK589215
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)CSc1nnc(s1)N1C(c2cccc(c2)OCc2ccccc2)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK589216
Synonyms: 8-(2,4-dimethoxyphenyl)-3-(4-fluorobenzyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cc(OC)ccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STK589217
Synonyms: 9-(naphthalen-1-yl)-6-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2cccc4c2cccc4)ncn3)CC(C1)c1cccs1

STK589218
Synonyms: ethyl7-(2,4-dimethoxyphenyl)-2-methyl-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1OC)OC)nc([nH]2)C)c1ccccc1

STK589219
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)ccc(c1)C

STK589220
Synonyms: 5-bromo-3-methyl-N-[3-(morpholin-4-yl)propyl]-1H-indole-2-carboxamide
Smiles: Brc1ccc2c(c1)c(C)c([nH]2)C(=O)NCCCN1CCOCC1

STK589221
Synonyms: N-[(2Z)-5,5-dioxido-3-(4-phenoxyphenyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: O=C(C(C)C)/N=C/1\SC2C(N1c1ccc(cc1)Oc1ccccc1)CS(=O)(=O)C2

STK589223
Synonyms: 2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(3-hydroxypropyl)acetamide
Smiles: OCCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F

STK589224
Synonyms: 11-chloro-3-(3,4-dimethoxyphenyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Smiles: COc1cc(ccc1OC)N1COc2c(C1)c1oc(=O)c3c(c1cc2Cl)CCC3

STK589225
Synonyms: 3-methyl-N-[2-(morpholin-4-yl)ethyl]-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CCC2)NCCN1CCOCC1

STK589226
Synonyms: N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-N-methyl-2-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(N(CC(=O)c1ccc(c(c1)O)O)C)CN1C(=S)S/C(=C\c2cccs2)/C1=O

STK589228
Synonyms: 2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1ccccc1F

STK589229
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1COc1ccccc1

STK589230
Synonyms: 5-(pyridin-2-yl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc(cc1)C(F)(F)F)c1ccccn1

STK589233
Synonyms: 9-(5-methyl-1,2-oxazol-3-yl)-8-[4-(propan-2-yl)phenyl]-8,9-dihydrobenzo[7,8]chromeno[2,3-c]pyrrole-7,10-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)C(C)C)c(=O)c1c(o2)c2ccccc2cc1

STK589235
Synonyms: (2Z)-2-(2-chloro-6-fluorobenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2c(F)cccc2Cl)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK589236
Synonyms: 4-fluoro-N-[3-oxo-2-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-2-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(Nc2n(C1=O)c1c(n2)cccc1)C(F)(F)F

STK589238
Synonyms: 2-(3-bromo-4-methoxyphenyl)-5-(2,3-dichlorophenyl)-4-phenyl-1H-imidazole
Smiles: COc1ccc(cc1Br)c1[nH]c(c(n1)c1ccccc1)c1cccc(c1Cl)Cl

STK589239
Synonyms: N-(biphenyl-2-yl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1ccccn1

STK589240
Synonyms: 6-chloro-4-phenyl-9-(pyridin-3-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c1CN(COc1c(c2)Cl)Cc1cccnc1

STK589241
Synonyms: [10-(4-chlorophenyl)-2,6,8-trioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]aceticacid
Smiles: OC(=O)CN1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2ccc(cc2)Cl)sc(=O)[nH]1

STK589242
Synonyms: (5E)-2-(4-benzylpiperazin-1-yl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccc(o1)c1cccc(c1)C(F)(F)F)N1CCN(CC1)Cc1ccccc1

STK589243
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2-ethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK589244
Synonyms: 4-imino-2-(4-methoxyphenyl)-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccc(cc1)OC

STK589245
Synonyms: 6-chloro-3,4-dimethyl-9-(pyridin-2-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: Clc1cc2c(c3c1OCN(C3)Cc1ccccn1)oc(=O)c(c2C)C

STK589246
Synonyms: (2Z)-6-[(3-chlorobenzyl)oxy]-2-(pyridin-4-ylmethylidene)-1-benzofuran-3(2H)-one
Smiles: Clc1cccc(c1)COc1ccc2c(c1)O/C(=C\c1ccncc1)/C2=O

STK589247
Synonyms: 4-(4-chloro-3-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)CCCOc1ccc(c(c1)C)Cl

STK589248
Synonyms: 2-amino-4-(2-fluorophenyl)-5-hydroxy-7-methyl-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1F)c(O)nc(c2)C

STK589249
Synonyms: 3-(4-chlorophenyl)-7-(4-fluorophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Fc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)Cl

STK589252
Synonyms: 4-{[(E)-(2-methoxyphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK589253
Synonyms: N-(2-tert-butylphenyl)-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1COc1ccc(cc1)C

STK589254
Synonyms: 5-(furan-2-yl)-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccco1

STK589255
Synonyms: 4-(6-hydroxy-1,3-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)phenyl(2E)-3-(4-nitrophenyl)prop-2-enoate
Smiles: O=C(Oc1ccc(cc1)C1C2=C(O)c3c(C2=Nc2c1c(=O)n(C)c(=O)n2C)cccc3)/C=C/c1ccc(cc1)[N+](=O)[O-]

STK589257
Synonyms: 2-[ethyl(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl)amino]ethanol
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3N(CCO)CC

STK589258
Synonyms: 6-chloro-N-[(2Z)-5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-7-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: Fc1ccc(cc1)CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)/s1

STK589259
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2OC)OC)nnc1Cc1cccs1

STK589260
Synonyms: 8-(4-butylphenyl)-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: CCCCc1ccc(cc1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK589261
Synonyms: 8-bromo-6-hydroxy-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(CCCSc1ncccn1)c(n2)Br)C

STK589262
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)-2'-hydroxy-8-nitro-1'-(propan-2-yl)-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CC(N1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-])O)C

STK589264
Synonyms: 7'-{(E)-[1-(4-chlorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trion
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK589265
Synonyms: 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Clc1ccc(cc1)SCc1cc(O)c2c(n1)[nH]n(c2=O)c1nc(C)cc(n1)C

STK589266
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1'-[2-(dimethylammonio)ethyl]-1-ethyl-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}methanolate
Smiles: CCN1c2ccccc2C2(C1=O)/C(=C(/c1ccc3c(c1)OCCO3)\[O-])/C(=O)C(=O)N2CC[NH+](C)C

STK589268
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK589269
Synonyms: (E)-1-benzofuran-2-yl{1-ethyl-1'-[2-(morpholin-4-ium-4-yl)ethyl]-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}methanolate
Smiles: CCN1c2ccccc2C2(C1=O)N(CC[NH+]1CCOCC1)C(=O)C(=O)/C/2=C(\c1cc2c(o1)cccc2)/[O-]

STK589270
Synonyms: 2-[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK589272
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl)C

STK589273
Synonyms: N-[(2Z)-1,3-benzoxazol-2(3H)-ylidene]-5-butyl-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: CCCCN1CNC(=NC1)/N=c/1\oc2c([nH]1)cccc2

STK589275
Synonyms: 7'-{[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: SC1=NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=N1)O

STK589276
Synonyms: 3-(2-methoxyphenyl)-5-[(3-methylbenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCc1cccc(c1)C

STK589277
Synonyms: 3-(2,6-dichlorobenzyl)-1,6,7,8-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1cccc(c1Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)C)Cl

STK589279
Synonyms: 1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCCN1Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK589280
Synonyms: 7-fluoro-2-(6-methylpyridin-2-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1cccc(n1)C

STK589281
Synonyms: 2-(3,4-diethoxyphenyl)-4-imino-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCOc1cc(ccc1OCC)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

STK589282
Synonyms: 1,3-dimethyl-7-(3-methylbutyl)-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(CN2CCCCC2)nc2c1c(=O)n(c(=O)n2C)C)C

STK589284
Synonyms: 4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[3-(propan-2-yloxy)propyl]benzamide
Smiles: CC(OCCCNC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK589285
Synonyms: (1'R,2'R)-7'-chloro-2'-(pyridin-3-yl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2cccs2)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccnc1

STK589289
Synonyms: 2-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-ol
Smiles: Clc1ccc(cc1)c1cc2n(n1)c(O)c1c(n2)CCC1

STK589290
Synonyms: tert-butyl(3S)-3-(cycloheptylcarbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C([C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)NC1CCCCCC1

STK589291
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](CC)CC

STK589292
Synonyms: 6-methyl-9-(pyridin-4-ylmethyl)-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCC2)Cc1ccncc1

STK589294
Synonyms: N-(3,4-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK589295
Synonyms: N-(2,4-difluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc(cc1F)F

STK589296
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-3-(4-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)O

STK589297
Synonyms: ethyl2-amino-1',5'-dimethyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C31C(=O)N(c1c3cc(C)cc1)C)C(=O)CCC2

STK589298
Synonyms: 4-hydroxy-8-(3-methoxypropyl)-1-methyl-7-phenyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COCCCn1c(cn2c1nc1c2c(O)nc(=O)n1C)c1ccccc1

STK589300
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O)C

STK589302
Synonyms: 3-[(3R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoicacid
Smiles: OC(=O)CC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1

STK589304
Synonyms: 8-[(4-ethylpiperazin-1-ium-1-yl)methyl]-3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)Oc1cccc(c1)OC)C(F)(F)F

STK589305
Synonyms: (4Z)-4-(hydroxyimino)-3,6,6-trimethyl-N-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)Nc1cccc(c1)C(F)(F)F

STK589306
Synonyms: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1OC)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK589308
Synonyms: (4E)-2-(3,4-dimethylphenyl)-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\NCc1ccccn1)cccc2

STK589311
Synonyms: (2'S,3S,3'S,10b'R)-3'-(1,3-benzodioxol-5-ylcarbonyl)-2'-(pyridin-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccn1)C(=O)Nc1c2cccc1)cccc3)c1ccc2c(c1)OCO2

STK589312
Synonyms: propan-2-yl{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Smiles: N#CC1=C(SCC(=O)OC(C)C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK589313
Synonyms: (1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-7'-methyl-2'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Cc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C(C)(C)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1

STK589314
Synonyms: N-(3,5-dimethoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1cc(cc(c1)OC)Nc1cc(C)nc2n1ncn2

STK589316
Synonyms: N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(Cl)c(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1Cl)C

STK589317
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-(4-methoxyphenyl)-6-[3-(trifluoromethyl)phenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK589318
Synonyms: methyl3-{[(2,4-dimethoxyphenyl)sulfonyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: COc1ccc(c(c1)OC)S(=O)(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OC

STK589319
Synonyms: 6-(4-ethylphenyl)-7-hydroxy-2,9,9-trimethyl-6,8,9,10-tetrahydro[1,2,4]triazolo[5',1':2,3]pyrimido[4,5-b]quinolin-5(4H)-one
Smiles: CCc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(=O)[nH]c1n2nc(n1)C)(C)C

STK589320
Synonyms: 4-(4-methoxyphenyl)-9-(pyridin-4-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc1c2CN(CO1)Cc1ccncc1

STK589321
Synonyms: N-(2,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: COc1ccc(cc1NC(=O)c1nn2c(n1)nc(cc2C)C)OC

STK589322
Synonyms: 7-chloro-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK589324
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2-propoxyphenyl)carbonyl]-2'-(pyridin-3-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccnc1)C(=O)Nc1c2cccc1)cccc3

STK589325
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK589326
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccncc1)/C2=O

STK589327
Synonyms: 1-(3-chloro-4-fluorophenyl)-4-(2,4-dimethoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(c(c1)OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(c(c1)Cl)F

STK589328
Synonyms: ethyl(2E)-2-{[(3,5-dimethoxyphenyl)carbonyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N/C(=O)c2cc(OC)cc(c2)OC)/[nH]c1C

STK589329
Synonyms: N-[5-(acetylamino)-2-methoxyphenyl]-2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1CC)c1ccc(cc1)Cl)NC(=O)C

STK589330
Synonyms: 3-[7-(3,4-dichlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Oc1cccc(c1)c1nnc2n1cnc1c2cnn1c1ccc(c(c1)Cl)Cl

STK589336
Synonyms: 4-{[({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1COc1ccc(cc1)C

STK589337
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN(c1ccccc1)C)C(=O)N/N=C/1\C(=O)Nc2c1cccc2

STK589338
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK589341
Synonyms: 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Smiles: CCc1sc2c(c1)c(ncn2)SCC(=O)Nc1ccc(cc1)F

STK589342
Synonyms: 1-benzyl4-(6-oxo-6H-benzo[c]chromen-3-yl)piperidine-1,4-dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OCc1ccccc1)Oc1ccc2c(c1)oc(=O)c1c2cccc1

STK589343
Synonyms: 7-hydroxy-9-(4-methoxyphenyl)-1-methyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCn1c(=O)n(C)c2c(c1=O)n1CC(O)CN(c1n2)c1ccc(cc1)OC

STK589345
Synonyms: 4-fluoro-N-[6-methyl-2-(4-methylphenyl)-5-oxo-4-phenyl-2,5-dihydropyridazin-3-yl]benzamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccc(cc1)F)c1ccccc1

STK589346
Synonyms: 9,10-dimethoxy-3,3-dimethyl-13-phenyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccccc2)C2=C1CC(CC2=O)(C)C

STK589347
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Smiles: COc1ccc(cc1OC)C1=NOC(C1)C(=O)Nc1ccc2c(c1)OCCO2

STK589348
Synonyms: 1'-[2-(3,4-dimethoxyphenyl)ethyl]-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CCCCC1

STK589349
Synonyms: N,N-dimethyl-N'-[3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]benzene-1,4-diamine
Smiles: CC(c1cc(Nc2ccc(cc2)N(C)C)n2c(n1)c(cn2)c1ccccc1)C

STK589351
Synonyms: 4-{[(E)-(4-ethylphenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)CC

STK589352
Synonyms: 2-ethyl-N-[(2Z)-3-(2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]butanamide
Smiles: CCC(C(=O)/N=C/1\SC2C(N1c1ccccc1OC)CS(=O)(=O)C2)CC

STK589353
Synonyms: 6-benzyl-2-[(2,6-dichlorobenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)NCc1c(Cl)cccc1Cl

STK589354
Synonyms: 2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK589358
Synonyms: N-cyclohexyl-N~2~-{[1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]carbonyl}-L-valinamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NC1CCCCC1)C(C)C

STK589359
Synonyms: (4E)-2-(2-chloro-4-fluorophenyl)-4-({[3-(methylsulfanyl)phenyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CSc1cccc(c1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1Cl)F

STK589360
Synonyms: 1-(2,4-dimethoxyphenyl)-2-(6-ethyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(c(c1)OC)C1N(c2nc3c(s2)cc(cc3)CC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK589361
Synonyms: (3E)-4-imino-3-[(4-oxo-4H-chromen-3-yl)methylidene]-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=c1c(coc2c1cccc2)/C=C\1/C(=O)N=c2n(C1=N)c1ccccc1s2

STK589363
Synonyms: 1'-cyclohexyl-2'-hydroxy-3-nitro-6a,7,8,9,10,11-hexahydro-4'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: OC1=NC(=O)C2(C(=O)N1C1CCCCC1)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]

STK589364
Synonyms: (4E)-4-{[(4-hydroxyphenyl)amino]methylidene}-2-(6-methylpyridin-2-yl)isoquinoline-1,3(2H,4H)-dione
Smiles: Oc1ccc(cc1)N/C=C\1/C(=O)N(c2cccc(n2)C)C(=O)c2c1cccc2

STK589366
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-[(4-fluorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK589367
Synonyms: N-(2-ethoxyphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK589368
Synonyms: (1'S,3R,3'S,7a'S)-5''-fluoro-1'-[(3,4,5-trimethoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: COc1cc(cc(c1OC)OC)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(F)cc1

STK589369
Synonyms: N-(1-ethyl-4-oxo-3-phenyl-1,4-dihydroquinolin-2-yl)-2-fluorobenzamide
Smiles: CCn1c(NC(=O)c2ccccc2F)c(c2ccccc2)c(=O)c2c1cccc2

STK589370
Synonyms: 1-benzyl4-[4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl]piperidine-1,4-dicarboxylate
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2C)OC(=O)C1CCN(CC1)C(=O)OCc1ccccc1

STK589371
Synonyms: N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-{3-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-1H-pyrazole-3-carbohydrazide
Smiles: COc1cc(ccc1OCc1ccc(cc1)C)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(c(c1)OC)OC

STK589372
Synonyms: 8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

STK589374
Synonyms: 2-(3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C(C)(C)C)NCc1ccccn1

STK589375
Synonyms: 8-[(2,5-dimethylphenyl)sulfonyl]-7-methyl-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Cc1ccc(c(c1)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)C

STK589377
Synonyms: 7-(3,4-dimethylphenyl)-3-(2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1cc(ccc1C)n1ncc2c1ncn1c2nnc1c1ccccc1C

STK589378
Synonyms: 5-cyclohexyl-4-{[(E)-(4-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1ccc(cc1)/C=N/n1c(=S)[nH]nc1C1CCCCC1

STK589379
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl)OC

STK589380
Synonyms: methylN-[(3-chloro-4-methylphenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(c(c1)Cl)C

STK589383
Synonyms: methyl2-[(8S,8aR,11aS)-9,11-dioxo-8-(phenylcarbonyl)-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]-4,5-dimethylthiophene-3-carboxylate
Smiles: COC(=O)c1c(sc(c1C)C)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccccc2)C=Cc2c1cccc2

STK589384
Synonyms: (3R,3'S,5'S)-5-chloro-N-(2,5-dimethoxyphenyl)-5',7-dimethyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1C)C)OC

STK589385
Synonyms: 1-(4-chlorophenyl)-2-(prop-2-en-1-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCN1C(=O)c2c(C1c1ccc(cc1)Cl)c(=O)c1c(o2)cccc1

STK589387
Synonyms: 8-[4-(2-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(3-methylbutyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl)C

STK589388
Synonyms: 4-chloro-N-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]phenylalanyl-L-valine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)NC(C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccc(cc1)Cl

STK589390
Synonyms: (3,4-difluorophenyl)(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)methanone
Smiles: O=C(c1ccc(c(c1)F)F)N1CCC2(CC1)NCCc1c2[nH]cn1

STK589391
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chlorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK589393
Synonyms: N-[4-(diethylamino)phenyl]-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide
Smiles: CCN(c1ccc(cc1)NC(=O)c1[nH]nc2c1CCCC2)CC

STK589394
Synonyms: 3-(4-chlorophenyl)-8-[(diethylammonio)methyl]-2-methyl-4-oxo-4H-chromen-7-olate
Smiles: CC[NH+](Cc1c([O-])ccc2c1oc(C)c(c2=O)c1ccc(cc1)Cl)CC

STK589395
Synonyms: (3S,3'R,3a'R,6a'S)-3'-[(4-chlorophenyl)(hydroxy)methyl]-5'-(2-methoxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2[C@@H](c2ccc(cc2)Cl)O)C(=O)Nc2c1cccc2

STK589396
Synonyms: N-(biphenyl-2-yl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1ccccn1

STK589397
Synonyms: methyl5-cyano-4-(4-ethoxyphenyl)-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2)CC)N=C(C1C(=O)OC)O)C#N

STK589398
Synonyms: (5E)-3-(furan-2-ylmethyl)-6-hydroxy-5-{[1-(3-phenoxypropyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cn(c3c2cccc3)CCCOc2ccccc2)/C(=O)N1Cc1ccco1

STK589399
Synonyms: N-hexyl-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: CCCCCCNC(=S)N1CCc2c(C1C)cc(c(c2)OC)OC

STK589401
Synonyms: 2,7,7-trimethyl-1-(pyridin-4-ylmethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Smiles: CC1=NC(C2=C(N1Cc1ccncc1)CC(CC2=O)(C)C)(C(F)(F)F)C(F)(F)F

STK589402
Synonyms: 3-(3-chlorophenyl)-2-(4-ethylpiperazin-1-yl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCN1CCN(CC1)c1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK589403
Synonyms: (1'S,3R,3'S,7a'S)-5''-methyl-1'-(naphthalen-2-ylcarbonyl)-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Cc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)cccc2

STK589404
Synonyms: N-[2-(furan-2-yl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2,2-diphenylacetamide
Smiles: O=C(C(c1ccccc1)c1ccccc1)Nc1cc(O)nc2n1nc(n2)c1ccco1

STK589405
Synonyms: N-(3-fluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK589407
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK589411
Synonyms: N-(2-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK589412
Synonyms: N-(butan-2-yl)-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide
Smiles: CCC(NC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK589414
Synonyms: ethyl3-{[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK589415
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-[4-methyl-3-(morpholin-4-ylsulfonyl)phenyl]acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1ccc(c(c1)S(=O)(=O)N1CCOCC1)C

STK589417
Synonyms: 1-(4-fluorophenyl)-2-(4-methoxybenzyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)CN1C(=O)c2c(C1c1ccc(cc1)F)c(=O)c1c(o2)cccc1

STK589418
Synonyms: 2-(1-phenylethyl)-2,3-dihydro-1H-isoindol-1-imine
Smiles: CC(N1Cc2c(C1=N)cccc2)c1ccccc1

STK589419
Synonyms: 1-(4-ethoxyphenyl)-N-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)C)n2c3c1CCCCn3c(c2)c1ccccc1

STK589420
Synonyms: (5Z)-5-{1-[(4-fluorobenzyl)amino]propylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCc1ccc(cc1)F

STK589421
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)F

STK589422
Synonyms: 2-bromo-N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCCc1n[nH]/c(=N\C(=O)c2ccccc2Br)/s1

STK589424
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[(4-ethenylbenzyl)oxy]-4H-chromen-4-one
Smiles: C=Cc1ccc(cc1)COc1ccc2c(c1)occ(c2=O)c1ccc(c(c1)OC)OC

STK589426
Synonyms: N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1cccc(c1)OC

STK589427
Synonyms: 2-nitro-N-[(3Z)-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1ccccc1c2

STK589429
Synonyms: 7-methoxy-3-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}quinolin-2-ol
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1)O

STK589430
Synonyms: N-(3-chlorophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)Cl

STK589432
Synonyms: 3-cyclohexyl-10-methyl-2-(propan-2-yl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(c1nc2c(c(=O)n1C1CCCCC1)c(=O)c1c(n2C)cccc1)C

STK589433
Synonyms: 7-methyl-8-(thiophen-2-ylsulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1cccs1

STK589434
Synonyms: 6-{(E)-[2-(2,4,6-trichlorophenyl)hydrazinylidene]methyl}quinoxaline
Smiles: Clc1cc(Cl)c(c(c1)Cl)N/N=C/c1ccc2c(c1)nccn2

STK589438
Synonyms: 9-(furan-2-yl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccco2)ncn3)CC(C1)c1ccccc1

STK589439
Synonyms: (E)-(4-chlorophenyl){1-[2-(diethylammonio)ethyl]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(ccc1O)C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/[O-]

STK589440
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK589442
Synonyms: 1-(3,4-dimethoxyphenyl)-2-(6-ethoxy-1,3-benzothiazol-2-yl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(c(c1)OC)OC)c(=O)c1c(o2)ccc(c1)C

STK589444
Synonyms: 4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)C

STK589445
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-methoxyphenyl)carbonyl]-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(C)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK589447
Synonyms: N-[(2E)-3-(3-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(4-fluorophenyl)acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1cccc(c1)Cl)CS(=O)(=O)C2)Cc1ccc(cc1)F

STK589449
Synonyms: (3a'S,6a'R)-5'-tert-butyl-5-fluoro-3'-(1-hydroxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C(O)C)C(=O)N2

STK589450
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(dimethylamino)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1Cl

STK589451
Synonyms: 3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Smiles: COc1cc(ccc1OC)C1=NOC(C1)C(=O)N

STK589453
Synonyms: 10a-[(E)-2-{4-[(3-chlorobenzyl)oxy]-3-ethoxyphenyl}ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCOc1cc(ccc1OCc1cccc(c1)Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STK589454
Synonyms: methyl(2-bromonaphtho[2,1-b]furan-1-yl)acetate
Smiles: COC(=O)Cc1c(Br)oc2c1c1ccccc1cc2

STK589455
Synonyms: (4E)-4-({[3-(diethylamino)propyl]amino}methylidene)-2-(2,4-dimethoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN(CCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1OC)OC)CC

STK589458
Synonyms: 2'-amino-7,7'-dimethyl-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[4,3-b]pyran]-3'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cccc1C)c(=O)oc(c2)C

STK589460
Synonyms: 2-{4-[7-(3-chlorobenzyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)Cl)c(O)nc(=O)n2C

STK589461
Synonyms: 3-[(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]propan-1-ol
Smiles: OCCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK589462
Synonyms: 8-(3-chlorophenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Clc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK589463
Synonyms: N-(2-{[(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino}butanoyl)-D-tryptophan
Smiles: CCC(C(=O)N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

STK589466
Synonyms: N-[(2Z)-3-(3-chloro-4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK589467
Synonyms: 3-(4-bromo-2-chlorophenyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: Brc1ccc(c(c1)Cl)N1C(=N)SC2C1CS(=O)(=O)C2

STK589468
Synonyms: 14-(4-fluorophenyl)-3,3-dimethyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Smiles: Fc1ccc(cc1)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCOc2c1

STK589470
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK589472
Synonyms: 3-(2-ethoxyphenyl)-2',6'-dihydroxy-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: CCOc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=NC1=O)O)O

STK589473
Synonyms: N-[(3Z)-6-methoxy-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]pyridine-3-carboxamide
Smiles: COc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N\C(=O)c1cccnc1)CC(C)C

STK589474
Synonyms: 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl-1H-indol-3-yl}-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: COc1ccc2c(c1)c(CC(=O)N1CCc3c(C1)cc(c(c3)OC)OC)c(n2C(=O)c1ccc(cc1)Cl)C

STK589478
Synonyms: 5-(3-bromophenyl)-3-(2-hydroxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: Brc1cccc(c1)N1C(=O)C2C(C1=O)C(NC2C(=O)O)c1ccccc1O

STK589480
Synonyms: ethyl4-[3-(2-methoxyethyl)-1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl]benzoate
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C(=O)OCC

STK589482
Synonyms: 3-[(6-bromoquinolin-8-yl)amino]-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1cc(Br)cc2c1nccc2

STK589483
Synonyms: [4-(2,3-dimethylphenyl)piperazin-1-yl](4,5,6,7-tetrahydro-2H-indazol-3-yl)methanone
Smiles: O=C(c1[nH]nc2c1CCCC2)N1CCN(CC1)c1cccc(c1C)C

STK589484
Synonyms: 1',3',13-trimethyl-1,2,3,4,5,5a-hexahydro-2'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-2',4',6',8(1'H,3'H)-tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C

STK589485
Synonyms: N-(2,4-difluorophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)Nc1ccc(cc1F)F

STK589486
Synonyms: 1-(4-bromobenzyl)-3,7-dimethyl-8-[(4-methylpiperazin-1-yl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)Nc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccc(cc1)Br

STK589488
Synonyms: 2-methoxy-6-[4-(4-methylphenoxy)quinazolin-2-yl]phenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccc(cc2)C)c2c(n1)cccc2

STK589489
Synonyms: 1-(3-methoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK589490
Synonyms: 1-(4-methoxyphenyl)-5-oxo-N-{(2S)-1-oxo-1-[(1-phenylpropan-2-yl)amino]propan-2-yl}pyrrolidine-3-carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NC(Cc1ccccc1)C)C

STK589491
Synonyms: 3-(4-fluorobenzyl)-5,8-dimethyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccc(cc1)Cn1cnc2c(c1=O)n(C)c1c2cc(cc1)C

STK589492
Synonyms: N-[(1Z)-1-{1-cyano-2-[(4-methylbenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]furan-2-carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccco1)/C(=O)NCc1ccc(cc1)C

STK589493
Synonyms: 2-hydroxy-3,6,6-trimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cn1c(O)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK589494
Synonyms: 2,2,5-trimethyl-8-(3-methylpiperidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC1CCCN(C1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK589495
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-ethoxy-3-methoxyphenyl)-7-fluoro-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK589497
Synonyms: 10-(4-ethylphenyl)-10H-indeno[1,2-d][1,2,4]triazolo[1,5-a]pyrimidin-9-ol
Smiles: CCc1ccc(cc1)C1n2ncnc2N=C2C1=C(O)c1c2cccc1

STK589498
Synonyms: (4Z)-2-phenyl-4-[4-(propan-2-yloxy)benzylidene]-4H-imidazol-5-ol
Smiles: CC(Oc1ccc(cc1)/C=C/1\N=C(N=C1O)c1ccccc1)C

STK589499
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK589500
Synonyms: 1'-butyl-6-hydroxy-3-(2-methylphenyl)-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=NC(=O)N(C2=O)c1ccccc1C)O)[N+](=O)[O-]

STK589502
Synonyms: 3-(3-chlorobenzyl)-8-(2-methoxyethyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)Cc1cccc(c1)Cl

STK589503
Synonyms: (10aS)-2-(2,4-dichlorophenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: Clc1ccc(c(c1)Cl)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK589505
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-5-fluoro-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cc(F)cc2)C

STK589506
Synonyms: ethyl2-[1-(4-methylphenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-1,3-benzothiazole-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C)c(=O)c1c(o2)cccc1

STK589507
Synonyms: N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CC(CN(S(=O)(=O)c1ccccc1)Cc1cc2ccccc2[nH]c1=O)C

STK589508
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Clc1cccc(c1)c1nnc(n1c1ccccc1)SCC(=O)Nc1cccc(c1C)Cl

STK589511
Synonyms: 2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK589512
Synonyms: 4,5,6-trimethoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)NCc1cccnc1

STK589514
Synonyms: 2-benzyl-8-(3-chlorophenyl)-10-methyl-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1cccc(c1)n1nc(c2c1Oc1ncn3c(c1C2c1cccnc1)nc(n3)Cc1ccccc1)C

STK589516
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2,5-dimethoxyphenyl)-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: COc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2Cl)OC

STK589518
Synonyms: 1-(3,4-dichlorophenyl)-7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c(=O)c1c(o2)ccc(c1)C

STK589521
Synonyms: N-(4-methoxyphenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1)OC

STK589523
Synonyms: N-[(2E)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=C\1/SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2

STK589524
Synonyms: N-[(2Z)-3-(3-acetylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1cccc(c1)C(=O)C)CS(=O)(=O)C2)Cc1ccccc1

STK589525
Synonyms: 1-(3-ethoxyphenyl)-2-(6-fluoro-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK589526
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1COc1ccccc1

STK589527
Synonyms: 1-(3,4-dichlorophenyl)-2-{[4-ethyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: CCn1c(SCC(=O)c2ccc(c(c2)Cl)Cl)nnc1Cc1cccs1

STK589529
Synonyms: 4-(5-chloro-2-methoxyphenyl)-5-(3,5-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)cc(c1)c1n[nH]c(=S)n1c1cc(Cl)ccc1OC

STK589530
Synonyms: N-(2,5-dimethoxyphenyl)-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: COc1ccc(c(c1)NC(=O)CCCCCn1cnc2c(c1=O)cccc2)OC

STK589531
Synonyms: N-(4-ethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK589532
Synonyms: 5-{3-[(4-chlorobenzyl)oxy]phenyl}-N'-[(E)-(2-hydroxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)c1[nH]nc(c1)C(=O)N/N=C/c1ccccc1O

STK589533
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)OC)nnc1COc1ccc(cc1)Cl

STK589534
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(4-methylphenyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)N(S(=O)(=O)c1ccccc1)Cc1cc2cc(C)ccc2[nH]c1=O

STK589535
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3,4-dimethoxyphenyl)carbonyl]-2'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cc(ccc1OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3

STK589536
Synonyms: 6-butyl-3-(3-hydroxypropyl)-10-methyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCCc1cc(=O)oc2c1cc1CN(CCCO)COc1c2C

STK589537
Synonyms: 1-(4-bromophenyl)-3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)pyrrolidine-2,5-dione
Smiles: COc1cc2c(cc1OC)CCN(C2C)C1CC(=O)N(C1=O)c1ccc(cc1)Br

STK589540
Synonyms: N-{[(2Z)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(=S)/N=c/1\scc([nH]1)c1ccc(cc1)Cl

STK589541
Synonyms: 3-[4-(methoxycarbonyl)phenoxy]-8-[(4-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2C[NH+]1CCC(CC1)C)[O-]

STK589544
Synonyms: N-[(2E)-3-(2,5-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide
Smiles: COc1ccc(c(c1)N1/C(=N\C(=O)Cc2ccccc2)/SC2C1CS(=O)(=O)C2)OC

STK589546
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK589548
Synonyms: ethyl(2-benzyl-7-hydroxy-3-phenylpyrazolo[1,5-a]pyrimidin-5-yl)acetate
Smiles: CCOC(=O)Cc1cc(O)n2c(n1)c(c1ccccc1)c(n2)Cc1ccccc1

STK589549
Synonyms: (4E)-2-(2,4-dimethoxyphenyl)-4-({[2-(4-methoxyphenyl)ethyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(cc1)CCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1OC)OC

STK589551
Synonyms: N-{4-[4-(4-methoxyphenyl)-2-oxo-2H,8H-chromeno[8,7-e][1,3]oxazin-9(10H)-yl]phenyl}acetamide
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc1c2CN(CO1)c1ccc(cc1)NC(=O)C

STK589553
Synonyms: (2'S,3S,3'S,10b'R)-2'-(1,3-benzodioxol-5-ylcarbonyl)-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc4c(c1)OCO4)C(=O)Nc1c2cccc1)cccc3)c1cccs1

STK589554
Synonyms: 11-(furan-2-yl)-2-[(2-methoxyphenoxy)methyl]-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK589556
Synonyms: 6-hydroxy-3-methyl-8-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-7-(naphthalen-1-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)CN1CCN(CC1)c1nc2c(n1Cc1cccc3c1cccc3)c(O)nc(=O)n2C

STK589557
Synonyms: N-(2,4-dimethylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK589558
Synonyms: 9-chloro-2-(4-methoxyphenyl)-5-[4-(propan-2-yl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1=NN2C(C1)c1cc(Cl)ccc1OC2c1ccc(cc1)C(C)C

STK589559
Synonyms: 8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nc2c1c(=O)n(c(=O)n2C)C)C

STK589561
Synonyms: N-(2,4-dichlorophenyl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2Cl)Cl)nnc1c1ccccc1F

STK589563
Synonyms: N-(3-bromobenzyl)-3-(2,2-dichloroethenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2,2-dimethylcyclopropanecarboxamide
Smiles: ClC(=CC1C(C1(C)C)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br)Cl

STK589564
Synonyms: tert-butyl(2S)-2-[5-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(o1)[C@@H]1CCCN1C(=O)OC(C)(C)C

STK589566
Synonyms: 5-(2-methoxyphenyl)-4-{[(E)-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1

STK589568
Synonyms: 1-(3-nitrophenyl)-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: [O-][N+](=O)c1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK589569
Synonyms: N-(2-bromophenyl)-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1ccccc1Br

STK589571
Synonyms: (4E)-4-[(4-chlorophenyl)imino]-6-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Clc1ccc(cc1)/N=c\1/nc(N)nc([nH]1)CN1CCN(CC1)c1ccccn1

STK589573
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(3-fluorophenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK589575
Synonyms: N-(4-chlorophenyl)-2-[3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-2-oxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetamide
Smiles: O=C(Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C)Nc1ccc(cc1)Cl

STK589576
Synonyms: N-(7-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-1-yl)furan-2-carboxamide
Smiles: Cc1ccc2c(c1)nc1c(c2)CCN1NC(=O)c1ccco1

STK589577
Synonyms: 1-(3,4-dimethylphenyl)-N,4-bis(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(c2ccc(c(c2)C)C)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

STK589578
Synonyms: 2-methyl-7-[(2-phenylethyl)sulfanyl]-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: Cc1nn2c(n1)c1c3CCCCc3sc1n1c2nnc1SCCc1ccccc1

STK589581
Synonyms: (4Z)-4-(3-bromo-4-nitrobenzylidene)-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Br)[N+](=O)[O-])c1cccc2c1cccc2

STK589582
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1C)c1cccc(c1)Cl

STK589586
Synonyms: 3-(dimethylsulfamoyl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]benzamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)c1cccc(c1)S(=O)(=O)N(C)C

STK589587
Synonyms: 1'-ethyl-4-methyl-3,4-dihydro-1H,2'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1C(=O)NC(=O)C2(C1=O)CN(C)c1c(C2)c2ccccc2cc1

STK589589
Synonyms: ethyl4-[1-amino-9,10-dioxo-4-(propan-2-ylamino)-9,10-dihydroanthracen-2-yl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1cc(NC(C)C)c2c(c1N)C(=O)c1c(C2=O)cccc1

STK589590
Synonyms: 5-amino-11-(furan-2-yl)-8-(4-methylphenyl)-9-oxo-9,10,11,12-tetrahydro-8H-quino[1,2-a]quinazoline-7-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc(cc1)C)C(=O)CC(C2)c1ccco1)cccc3

STK589591
Synonyms: N-(4-ethylphenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK589592
Synonyms: 2-(4-chlorophenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C(Oc1ccc(cc1)Cl)C

STK589594
Synonyms: N-(3-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK589595
Synonyms: 2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1cc(C)cc2c1c1CCCCc1c(=O)o2

STK589596
Synonyms: (2Z,5Z)-5-(3,4-dimethoxybenzylidene)-2-[(4-hydroxyphenyl)imino]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: COc1cc(ccc1OC)/C=C/1\S/C(=N\c2ccc(cc2)O)/N=C1O

STK589597
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

STK589598
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-2-(3-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)C)/C2=O

STK589599
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1Cc1cccs1

STK589600
Synonyms: 2-[(2E)-{[5-(2-nitrophenyl)furan-2-yl]methylidene}hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: [O-][N+](=O)c1ccccc1c1ccc(o1)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK589603
Synonyms: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CSc1scc(n1)C

STK589604
Synonyms: 4-[(6E)-6-(4-fluorobenzylidene)-5-iminio-7-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl]phenolate
Smiles: [O-]c1ccc(cc1)c1sc2=NC(=O)/C(=C/c3ccc(cc3)F)/C(=[NH2+])n2n1

STK589606
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)cc(c2)Cl)N=C2C(=C(O)CCC2)C1c1ccco1

STK589607
Synonyms: 9-chloro-2-(4-fluorophenyl)-5-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1cccc(c1)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)F)Cl

STK589609
Synonyms: 3-(2-hydroxyethyl)-4-imino-5-(2-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: OCCn1cnc2c(c1=N)C(c1ccccc1OC)c1c(O2)cc(cc1)O

STK589613
Synonyms: N-(furan-2-ylmethyl)-3,4,5-trimethoxy-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)N(Cc1cc2ccccc2[nH]c1=O)Cc1ccco1

STK589615
Synonyms: 3-[(3a'S,6a'R)-7-chloro-5'-(2-chlorobenzyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl

STK589616
Synonyms: 3-{[2-(ethylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-dimethylpropan-1-amine
Smiles: CCSc1nc(SCCCN(C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK589619
Synonyms: 8-hydrazinyl-6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: NNc1nc2c(n1CCc1ccc(cc1)OC)c(O)nc(=O)n2C

STK589620
Synonyms: 4-{[(E)-(2-methylphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1C)C

STK589621
Synonyms: (4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589622
Synonyms: 4-[(2E)-2-(2-methoxybenzylidene)hydrazinyl]-5H-pyrimido[5,4-b]indole
Smiles: COc1ccccc1/C=N/Nc1ncnc2c1[nH]c1c2cccc1

STK589623
Synonyms: N'-[(E)-(3-hydroxyphenyl)methylidene]-5-[4-(2-phenylethoxy)phenyl]-1H-pyrazole-3-carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1n[nH]c(c1)c1ccc(cc1)OCCc1ccccc1

STK589624
Synonyms: N-[3-(3-chlorophenyl)-4-oxo-4H-chromen-2-yl]-2-(thiophen-2-yl)acetamide
Smiles: O=C(Nc1oc2ccccc2c(=O)c1c1cccc(c1)Cl)Cc1cccs1

STK589628
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-5-methyl-6-(2-methylbenzyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccc(cc1)CSc1nn2c(n1)nc(c(c2O)Cc1ccccc1C)C

STK589629
Synonyms: 2-(2-chlorophenyl)-N-[(2Z)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(Cc1ccccc1Cl)/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK589630
Synonyms: N-(3,4-difluorophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccccc1)c1nccnc1

STK589631
Synonyms: N-[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]norvalyl-S-benzyl-L-cysteine
Smiles: CCCC(C(=O)N[C@H](C(=O)O)CSCc1ccccc1)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C

STK589632
Synonyms: 3-[3-(4-chlorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(2-methoxyethyl)propanamide
Smiles: COCCNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Cl

STK589633
Synonyms: 3-[(3-fluorobenzyl)sulfanyl]-5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(SCc2cccc(c2)F)nnc1c1ccc(cc1)F

STK589634
Synonyms: 4-(10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)c1ccc(cc1)O

STK589636
Synonyms: 2,5-dioxopyrrolidin-1-ylN-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-valinate
Smiles: O=C1Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)ON1C(=O)CCC1=O)C(C)C

STK589638
Synonyms: 1-(3,4-dichlorophenyl)-6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c(=O)c1c(o2)cc(c(c1)C)C

STK589641
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-yl2-{[(benzyloxy)carbonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NC(=O)OCc1ccccc1

STK589642
Synonyms: N-(3-chlorophenyl)-2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3cccc(c3)Cl)nnc2c2c1CC(C)(C)OC2

STK589643
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2C)nnc1c1cccc(c1)Cl

STK589644
Synonyms: 4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl]-N,N-diethylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cc(c(c2)OC)OC)CC

STK589645
Synonyms: (E)-N-[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(2-methoxyphenyl)methanimine
Smiles: COc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK589647
Synonyms: 8-amino-3-ethyl-1',3'-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)N)C(=O)N(C)C(=O)N(C1=O)C

STK589648
Synonyms: 4-{[(2E,5E)-4-hydroxy-5-(4-methoxybenzylidene)-1,3-thiazol-2(5H)-ylidene]amino}benzenesulfonamide
Smiles: COc1ccc(cc1)/C=C\1/S/C(=N/c2ccc(cc2)S(=O)(=O)N)/N=C1O

STK589649
Synonyms: 2-[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c1c2cccc1)NCc1cccnc1

STK589650
Synonyms: 1-(4-ethoxyphenyl)-N,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccccc2)n2c3c1CCCCn3c(c2)c1ccccc1

STK589651
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK589652
Synonyms: 8-[(4-benzylpiperazin-1-yl)methyl]-6-hydroxy-3-methyl-7-(2-methylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(Cn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(O)nc(=O)n2C)C

STK589653
Synonyms: (3a'R,8b'S)-2'-(butan-2-yl)-5-fluoro-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: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2)C

STK589654
Synonyms: 2-{5-[(3-methoxybenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)n1c(SCc2cccc(c2)OC)nnc1c1ccccn1

STK589655
Synonyms: (4E)-1-benzyl-5-(4-bromophenyl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1N(Cc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)C)/O

STK589656
Synonyms: (3a'S,6a'R)-5'-(2-chlorobenzyl)-5-fluoro-3'-(1-hydroxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(O)C)C(=O)N2

STK589657
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1COc1ccccc1

STK589659
Synonyms: N-(3,5-dichlorophenyl)-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CCCCCn1cnc2c(c1=O)cccc2

STK589660
Synonyms: 6-chloro-4-ethyl-9-(3,4,5-trimethoxyphenyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1cc(cc(c1OC)OC)N1COc2c(C1)c1oc(=O)cc(c1cc2Cl)CC

STK589661
Synonyms: 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-[3-(morpholin-4-yl)propyl]propanamide
Smiles: O=C(C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)C)NCCCN1CCOCC1

STK589662
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589664
Synonyms: 1-(4-fluorophenyl)-N-(3-methoxyphenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)OC)c1ccc(cc1)F

STK589665
Synonyms: 2-[(3a'S,6a'R)-5'-(2-chlorobenzyl)-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1C

STK589666
Synonyms: 2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK589667
Synonyms: ethyl2'-hydroxy-1'-methyl-8-nitro-4',6'-dioxo-1',2,3,4,4a,6'-hexahydro-1H,4'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C)O

STK589669
Synonyms: N-(2-bromo-4-methylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2Br)C)nnc1COc1ccc(cc1)Cl

STK589670
Synonyms: N-[(2Z)-3-(3-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1cccc(c1)Cl)CS(=O)(=O)C2

STK589671
Synonyms: 1'-(4-methylphenyl)-8-nitro-3-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1)[N+](=O)[O-]

STK589672
Synonyms: 3-[(2-chlorobenzyl)sulfanyl]-4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCc1ccccc1Cl

STK589673
Synonyms: 13-(4-fluorophenyl)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccc(cc2)F)C2=C1CC(CC2=O)(C)C

STK589674
Synonyms: 7-(furan-2-yl)-5-hydroxy-4-(4-hydroxyphenyl)-2-methyl-N-(pyridin-2-yl)-4,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: Oc1ccc(cc1)C1C(=C(C)N=C2C1=C(O)CC(C2)c1ccco1)C(=O)Nc1ccccn1

STK589676
Synonyms: 2-[(Z)-(2-oxo-4-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl7,8-dimethoxy-1-oxo-1H-isothiochromene-3-carboxylate
Smiles: COc1c(OC)ccc2c1c(=O)sc(c2)C(=O)Oc1ccccc1/C=C/1\SC(=O)NC1=S

STK589677
Synonyms: 4-({(2'S,3S,3'S,10b'R)-2'-[(4-methylphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)cccc3

STK589678
Synonyms: pentyl[3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-2-oxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetate
Smiles: CCCCCOC(=O)Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C

STK589679
Synonyms: 4-methoxy-N-(2-methoxyethyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COCCN(C(=O)c1ccc(cc1)OC)Cc1cc2ccccc2[nH]c1=O

STK589681
Synonyms: 4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1Br

STK589683
Synonyms: 3-(3-chlorophenyl)-7-(3,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1cccc(c1)c1nnc2n1cnc1c2cnn1c1ccc(c(c1)C)C

STK589685
Synonyms: N'-[(E)-1H-indol-3-ylmethylidene]-5-[4-(2-phenylethoxy)phenyl]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCCc1ccccc1)N/N=C/c1c[nH]c2c1cccc2

STK589686
Synonyms: 4-chloro-N-[(3Z)-8-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1c(C)cccc1c2

STK589688
Synonyms: N-[2-(4-chlorophenyl)-6-methyl-5-oxo-4-phenyl-2,5-dihydropyridazin-3-yl]-4-nitrobenzamide
Smiles: Clc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK589690
Synonyms: 1-(3-methylphenyl)-6-(2-phenylethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1cccc(c1)n1c(S)nc(=O)c2c1NCN(C2)CCc1ccccc1

STK589692
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-{[2-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK589693
Synonyms: (2Z)-2-(3-fluorobenzylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)F)/C2=O

STK589695
Synonyms: ethyl4-(4-hydroxy-1-methyl-2-oxo-1,2,7,8-tetrahydropyrimido[2,1-f]purin-9(6H)-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCCn2c1nc1c2c(O)nc(=O)n1C

STK589697
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cccnc1)/C2=O

STK589698
Synonyms: (2-bromophenyl)(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccccc1Br

STK589699
Synonyms: methyl2-{3-[(Z)-(1-cyclohexyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O

STK589700
Synonyms: 1-benzyl-10'H-spiro[piperidine-4,4'-[1,3,5]triazino[1,2-a]benzimidazol]-2'-amine
Smiles: NC1=NC2(n3c(=N1)[nH]c1c3cccc1)CCN(CC2)Cc1ccccc1

STK589703
Synonyms: 2-(2-chlorophenyl)-3-(furan-2-ylmethyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Cn1c2nc(c3ccccc3Cl)n(c(=O)c2c(=O)c2c1cccc2)Cc1ccco1

STK589704
Synonyms: N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[5-(2-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(C)c(cc2OC)Cl)nnc1c1ccccc1Cl

STK589705
Synonyms: (2Z)-2-(5-bromo-2-methoxybenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-])Br

STK589706
Synonyms: 9-(3-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cccc(c1)C

STK589708
Synonyms: 3-chloro-N-[(1Z)-1-{1-cyano-2-[(4-methylbenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccc(c1)Cl)/C(=O)NCc1ccc(cc1)C

STK589709
Synonyms: methyl4-{[4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-3-oxobutanoate
Smiles: COC(=O)CC(=O)CSc1nc(cc(c1C#N)c1ccc(cc1)Cl)c1cccs1

STK589710
Synonyms: 3-(2-chloro-6-fluorobenzyl)-8-(4-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STK589712
Synonyms: 2-[(3S,3'S,3a'R,6a'S)-5-bromo-2,4',6'-trioxo-5'-(tetrahydrofuran-2-ylmethyl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)C[C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cc(Br)cc1

STK589713
Synonyms: (1'S,3R,3'S,7a'S)-7''-chloro-1'-[(4-chlorophenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1Cl

STK589714
Synonyms: 8-(3-methoxyphenyl)-1-methyl-3-(naphthalen-1-ylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc2c1cccc2

STK589715
Synonyms: 2-(ethylsulfanyl)-9-(2-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccccc1OC

STK589716
Synonyms: 3-[(3a'S,6a'R)-5'-butyl-6,7-dimethyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1ccc(c2C)C

STK589717
Synonyms: N-(4-{(3E)-3-[hydroxy(phenyl)methylidene]-4,5-dioxo-2-phenylpyrrolidin-1-yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(c2ccccc2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK589718
Synonyms: 6-chloro-3-{[4-hydroxy-6-(4-methoxyphenyl)pyrimidin-2-yl]sulfanyl}-4-phenylquinolin-2-ol
Smiles: COc1ccc(cc1)c1cc(O)nc(n1)Sc1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK589720
Synonyms: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-[1-(phenylcarbonyl)piperidin-4-yl]ethanone
Smiles: COc1cc2/C(=C/C(=O)C3CCN(CC3)C(=O)c3ccccc3)/NCCc2cc1OC

STK589721
Synonyms: 5-[(2E)-3-(4-chlorophenyl)prop-2-enoyl]-2,6-dihydroxy-3-phenylpyrimidin-4(3H)-one
Smiles: Clc1ccc(cc1)/C=C/C(=O)c1c(O)nc(n(c1=O)c1ccccc1)O

STK589722
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylicacid
Smiles: OC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N

STK589725
Synonyms: 8-(3,4-dimethylphenyl)-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1ccc(cc1C)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK589728
Synonyms: 1-[2-(4-methoxyphenyl)-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK589729
Synonyms: 3-[(2-fluorobenzyl)sulfanyl]-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccccc1F)nn2)CCCC3

STK589730
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(3-chloro-4-fluorophenyl)-7-ethyl-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: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(c(c1)Cl)F

STK589731
Synonyms: N-[(2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]norleucine
Smiles: CCCCC(C(=O)O)NC(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1

STK589733
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK589734
Synonyms: 2-[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: CC(C(=O)NCc1cccnc1)Oc1ccc2c(c1C)oc(=O)c1c2cccc1

STK589738
Synonyms: 2-(4-methoxyphenyl)-7,7-dimethyl-4-(propan-2-ylsulfanyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: COc1ccc(cc1)c1nc(SC(C)C)c2c(n1)CC(OC2)(C)C

STK589739
Synonyms: (4E)-5-(4-bromophenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK589740
Synonyms: 2-{[4-amino-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chloro-2-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1N)c1ccccc1C

STK589741
Synonyms: 4-hydroxy-1,7-dimethyl-8-(4-methylphenyl)-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Cc1ccc(cc1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK589742
Synonyms: ethyl2-{[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NC(=NC2=O)S)O)sc(c1C)C

STK589743
Synonyms: 5-[(2E)-2-(6-amino-2-hydroxy-4-oxopyrimidin-5(4H)-ylidene)hydrazinyl]-2-chlorobenzoicacid
Smiles: OC1=NC(=O)/C(=N/Nc2ccc(c(c2)C(=O)O)Cl)/C(=N1)N

STK589744
Synonyms: (1S,2S)-N'-[(E)-(2-chloro-8-methylquinolin-3-yl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc2cccc(c2nc1Cl)C

STK589746
Synonyms: N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccccc1)Cc1cc2ccc(cc2[nH]c1=O)C

STK589747
Synonyms: (5Z)-3-cyclohexyl-5-{1-[(3,5-dimethoxybenzyl)amino]ethylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(CN/C(=C\2/C(=NC(=O)N(C2=O)C2CCCCC2)O)/C)cc(c1)OC

STK589749
Synonyms: 2-benzyl-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(Cc2ccccc2)C(c2c1oc1ccccc1c2=O)c1ccccn1

STK589750
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)-3-(2-chlorophenyl)-6-(4-chlorophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1O[C@H]2[C@H]2[C@@H]1ON=C2c1ccccc1Cl

STK589751
Synonyms: N-[(2E)-3-(2-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide
Smiles: O=C(/N=C\1/SC2C(N1Cc1ccccc1Cl)CS(=O)(=O)C2)Cc1ccccc1

STK589752
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)CSc1nnc(s1)N1C(c2cccc(c2)OCc2ccccc2)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK589753
Synonyms: N-(4-{(2-methylpropyl)[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]sulfamoyl}phenyl)acetamide
Smiles: CC(CN(S(=O)(=O)c1ccc(cc1)NC(=O)C)Cc1cc2ccccc2[nH]c1=O)C

STK589755
Synonyms: (4E)-5-(4-ethylphenyl)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK589756
Synonyms: N-[(2Z)-3-(3-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenoxyacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1cccc(c1)F)CS(=O)(=O)C2)COc1ccccc1

STK589758
Synonyms: 2-(3-chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1Oc2ccccc2C2N1N=C(C2)c1cccc(c1)Cl

STK589760
Synonyms: 3-(2-ethoxyphenoxy)-2-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCC1)[O-]

STK589761
Synonyms: (4E)-5-(3-butoxyphenyl)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589762
Synonyms: N-[2-chloro-5-(diethylsulfamoyl)phenyl]-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetamide
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)NC(=O)CN1CCc2c(C1)cc(c(c2)OC)OC)Cl)CC

STK589764
Synonyms: N-[5-hydroxy-2-(phenoxymethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]hexanamide
Smiles: CCCCCC(=O)Nc1cc(O)nc2n1nc(n2)COc1ccccc1

STK589765
Synonyms: 2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1COc1ccc(cc1)C

STK589768
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-5-(propan-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccccc1CSc1nn2c(n1)nc(cc2O)C(C)C

STK589770
Synonyms: N-(1,3-benzodioxol-5-yl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK589771
Synonyms: 2-{4-(4-methoxyphenyl)-5-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)n1c(SCc2cccc3c2cccc3)nnc1c1ccccn1

STK589773
Synonyms: (2'S,3S,3'S,10b'R)-2'-(furan-2-ylcarbonyl)-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3)C

STK589774
Synonyms: ethyl2-amino-1'-benzyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C31c1ccccc1N(C3=O)Cc1ccccc1)C(=O)CCC2

STK589775
Synonyms: N-(2-methoxyethyl)-8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: COCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)C

STK589776
Synonyms: N-[6-chloro-3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-2-yl]-4-fluorobenzamide
Smiles: COc1ccc(cc1OC)c1c(NC(=O)c2ccc(cc2)F)oc2c(c1=O)cc(cc2)Cl

STK589777
Synonyms: 4-{[(E)-(3,4-dichlorophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1Cl)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK589778
Synonyms: 9a-{(E)-2-[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]ethenyl}-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: CCOc1ccc(cc1)c1nn(cc1/C=C/C12NC(=O)CN1c1c(C2(C)C)cc(cc1)C)c1ccccc1

STK589779
Synonyms: N-(2-bromo-4-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)Nc1ccc(cc1Br)C

STK589780
Synonyms: 7-(2,6-dichlorobenzyl)-1,3-dimethyl-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1Cn1c(CN2CCCCC2)nc2c1c(=O)n(c(=O)n2C)C)Cl

STK589781
Synonyms: 2-cyclohexyl-10-methyl-3-(3-methylbutyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C1CCCCC1)C

STK589782
Synonyms: 1,4-dioxa-8-azaspiro[4.5]dec-8-yl(4,5,6-trimethoxy-1H-indol-2-yl)methanone
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)N1CCC2(CC1)OCCO2

STK589783
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK589784
Synonyms: (3a'S,6a'R)-7-chloro-5'-(3-methoxypropyl)-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cccc2Cl

STK589785
Synonyms: (5E)-6-hydroxy-5-({[1-(1H-indol-3-yl)butan-2-yl]amino}methylidene)-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C\NC(Cc2c[nH]c3c2cccc3)CC)/C1=O)O

STK589786
Synonyms: 2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)-N'-[(E)-(2-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CC1C(=NN=C1O)C

STK589787
Synonyms: (5Z)-3-{2-oxo-2-[2-(pyridin-3-yl)piperidin-1-yl]ethyl}-5-(thiophen-2-ylmethylidene)-1,3-thiazolidine-2,4-dione
Smiles: O=C(N1CCCCC1c1cccnc1)CN1C(=O)S/C(=C\c2cccs2)/C1=O

STK589789
Synonyms: (2E)-3-(2,4-dichlorophenyl)-2-(4-hydroxyquinazolin-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1Cl)Cl)/c1nc(O)c2c(n1)cccc2

STK589790
Synonyms: N-[2-(2-acetyl-4,5-dimethoxyphenyl)ethyl]-3-chloro-5-methoxy-4-(3-methylbutoxy)benzamide
Smiles: COc1cc(cc(c1OCCC(C)C)Cl)C(=O)NCCc1cc(OC)c(cc1C(=O)C)OC

STK589792
Synonyms: N-(1-benzylpiperidin-4-yl)-3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC1CCN(CC1)Cc1ccccc1

STK589793
Synonyms: N-{(2S)-1-[(3-methoxybenzyl)amino]-3-methyl-1-oxobutan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: COc1cccc(c1)CNC(=O)[C@H](C(C)C)NC(=O)N1CCn2c1nc1c2cccc1

STK589794
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1Cc1cccs1

STK589795
Synonyms: (2S)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-methyl-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)/N=c\1/sc2c([nH]1)cccc2)C

STK589798
Synonyms: (2E)-2-[(2E)-(2,6-dichlorobenzylidene)hydrazinylidene]-4-(3-nitrophenyl)-2,3-dihydro-1,3-thiazole
Smiles: Clc1cccc(c1/C=N/N=c\1/scc([nH]1)c1cccc(c1)[N+](=O)[O-])Cl

STK589801
Synonyms: (E)-[2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene](2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: COc1cc(cc(c1O)Br)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STK589802
Synonyms: 2',2',4-trimethyl-3,4-dihydro-1H-spiro[benzo[f]quinoline-2,5'-[1,3]dioxane]-4',6'-dione
Smiles: O=C1OC(C)(C)OC(=O)C21CN(C)c1c(C2)c2ccccc2cc1

STK589804
Synonyms: (4Z)-4-[(2-methoxyphenyl)imino]-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccccc2OC)/[nH]1

STK589805
Synonyms: N-[(2E)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(4-fluorophenyl)acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2)Cc1ccc(cc1)F

STK589806
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)OCc1ccccc1

STK589808
Synonyms: methylN-[(4-carbamoylpiperidin-1-yl)carbonyl]-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)N1CCC(CC1)C(=O)N)CC(C)C

STK589810
Synonyms: 8-{[(2-methoxyethyl)amino]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCNCc1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

STK589811
Synonyms: 3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-cyclopropylpropanamide
Smiles: O=C(NC1CC1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C

STK589813
Synonyms: N-(4-methoxybenzyl)-1-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-prolinamide
Smiles: COc1ccc(cc1)CNC(=O)[C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK589814
Synonyms: 2-{4-[6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-2-oxo-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: CC(=C)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)CC(=O)N

STK589815
Synonyms: 4-[({[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1C)c1cccc(c1)Cl

STK589816
Synonyms: [2-({(2'S,3S,3'S,10b'R)-2'-[(3-methoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)OC)C(=O)Nc1c2cccc1)cccc3

STK589817
Synonyms: (2'S,3S,3'S,10b'R)-2'-(furan-2-ylcarbonyl)-3'-[(3-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK589819
Synonyms: 4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2,4,5-trichlorophenyl)butanamide
Smiles: O=C(Nc1cc(Cl)c(cc1Cl)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK589820
Synonyms: 6-butyl-1-(3-chlorophenyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCCN1CNc2c(C1)c(=O)nc(n2c1cccc(c1)Cl)O

STK589823
Synonyms: 1-(2,3-dimethoxyphenyl)-7-fluoro-2-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)cccc1C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK589824
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589826
Synonyms: N-(2-methoxyphenyl)-2-(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetamide
Smiles: COc1ccccc1NC(=O)CC1NC(=O)c2c1cccc2

STK589830
Synonyms: N-(biphenyl-2-yl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1c1ccccc1)CSc1nnc(n1c1ccccc1)c1nccnc1

STK589831
Synonyms: N-(2,3-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1C)C)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK589835
Synonyms: 2-{[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)CCn1nnc2c(c1=O)cccc2

STK589836
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(3-ethoxy-4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(c(c2)OCC)O)c2c(C1=O)oc1c(c2=O)cccc1

STK589837
Synonyms: (2'S,3S,3'S,10b'R)-3'-(1,3-benzodioxol-5-ylcarbonyl)-2'-[(4-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK589838
Synonyms: 2-(4-methoxyphenyl)-N-[(2Z)-3-(2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=C/1\SC2C(N1c1ccccc1OC)CS(=O)(=O)C2

STK589839
Synonyms: N-(4-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK589841
Synonyms: 3-(benzylsulfanyl)-5-(2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCc1ccccc1

STK589842
Synonyms: 5-(2-methoxyphenyl)-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/C

STK589843
Synonyms: 4-[3-(pyrazin-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzenesulfonamide
Smiles: S=c1[nH]nc(n1c1ccc(cc1)S(=O)(=O)N)c1nccnc1

STK589847
Synonyms: 7-(4-fluorophenyl)-10-(4-methylphenyl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione
Smiles: Cc1ccc(cc1)C1C2C(Sc3c1sc(=O)[nH]3)C1CC2C2C1C(=O)N(C2=O)c1ccc(cc1)F

STK589849
Synonyms: 10-chloro-9-(3-chlorophenyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: Clc1cccc(c1)n1c(Cl)nc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)C

STK589851
Synonyms: 2-(diethylamino)ethyl4-{[(Z)-(4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C\1/C(=O)NC(=NC1=O)S)CC

STK589852
Synonyms: 2-(4-methoxyphenyl)-3-{2-[4-(2-methylbutan-2-yl)phenoxy]ethyl}quinazolin-4(3H)-one
Smiles: CCC(c1ccc(cc1)OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC)(C)C

STK589860
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-methoxyphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589861
Synonyms: (E)-{2-[3-(benzyloxy)phenyl]-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: C[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1cccc(c1)OCc1ccccc1)C

STK589863
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(3-ethoxyphenyl)-7-fluoro-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3C)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK589865
Synonyms: (5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\NCc2ccc3c(c2)OCO3)/C(=O)N1Cc1ccco1

STK589866
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-7-[4-(2-methylphenyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2N1CCN(CC1)c1ccccc1C)C(C)(C)C

STK589867
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1)F

STK589869
Synonyms: N,N-diethyl-N'-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]propane-1,3-diamine
Smiles: CCN(CCCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C)CC

STK589871
Synonyms: N-[(2E)-3-(2-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: O=C(/N=C\1/SC2C(N1Cc1ccccc1Cl)CS(=O)(=O)C2)CCc1ccccc1

STK589872
Synonyms: 3-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccc(cc1)C)c(SCC(=O)c1ccc(cc1)Cl)nn2

STK589873
Synonyms: 7,7-dimethyl-2-(3-methylphenyl)-4-{[2-(morpholin-4-yl)ethyl]sulfanyl}-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: Cc1cccc(c1)c1nc(SCCN2CCOCC2)c2c(n1)CC(OC2)(C)C

STK589874
Synonyms: N-(3,4-dimethoxyphenyl)-2-{[5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1F

STK589875
Synonyms: 3-{(3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}propanamide
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3CCC(=O)N)C(=O)Nc3c2cccc3)ccc1OC

STK589876
Synonyms: 4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(2-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccccc1F)Br

STK589878
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK589879
Synonyms: 4-({N-[(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]-D-leucyl}amino)butanoicacid
Smiles: CC(C[C@H](C(=O)NCCCC(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2)C

STK589881
Synonyms: (1-ethyl-4-nitro-1H-pyrazol-3-yl)[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone
Smiles: COc1ccccc1C1N(CCC2(C1CCCC2)O)C(=O)c1nn(cc1[N+](=O)[O-])CC

STK589882
Synonyms: (3R)-2,2-dimethyl-5-oxo-N-[(2S)-1-oxo-1-(1,3-thiazol-2-ylamino)propan-2-yl]-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)Nc1nccs1

STK589883
Synonyms: 4-{[({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1COc1ccc(cc1)C

STK589884
Synonyms: (4E)-5-(3-chlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589886
Synonyms: 3-butyl-8-chloro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK589888
Synonyms: 4-(4-chlorophenyl)-1-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Smiles: COc1cc2CN(CCc2cc1OC)Cc1nnc2n1c1ccccc1c(=O)n2c1ccc(cc1)Cl

STK589889
Synonyms: 1-(4-chlorophenyl)-N-(2-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccccc1NC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

STK589890
Synonyms: 2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1COc1ccc(cc1)C

STK589892
Synonyms: 1-(4-methoxyphenyl)-N-(3-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)C)n2c3c1CCCCn3c(c2)c1ccccc1

STK589895
Synonyms: N~2~-{[1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]carbonyl}-N-(1-phenylethyl)-L-valinamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NC(c1ccccc1)C)C(C)C

STK589897
Synonyms: 2-ethyl-3-(4-methoxybenzyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCc1nc2sc3ccccc3c(=O)c2c(=O)n1Cc1ccc(cc1)OC

STK589898
Synonyms: 1-methyl-8-(2-methylphenyl)-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK589899
Synonyms: N-[(2Z)-3-(4-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: Clc1ccc(cc1)CN1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2

STK589900
Synonyms: N-butyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C

STK589901
Synonyms: 2-(benzylsulfanyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2)nc(n3)SCc2ccccc2)CCC1

STK589902
Synonyms: (2E)-3-[2-(azepan-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCCCCC1)/S(=O)(=O)c1ccc(cc1)C

STK589904
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK589906
Synonyms: 10-(2,3-dimethoxyphenyl)-1,3-dimethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1cccc(c1OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK589907
Synonyms: (2-chloro-6-fluorophenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1c(F)cccc1Cl

STK589908
Synonyms: 2-[(2E)-2-(2,5-dimethylbenzylidene)hydrazinyl]-3-hydroxyquinazolin-4(3H)-one
Smiles: Cc1ccc(c(c1)/C=N/Nc1nc2ccccc2c(=O)n1O)C

STK589909
Synonyms: (5Z)-3-(4-chlorophenyl)-5-{1-[(2,5-dimethoxyphenyl)amino]ethylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/C)OC

STK589911
Synonyms: 9-(2-chloro-5-nitrophenyl)-6,6-dimethyl-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(C1=C(O)CC(CC1=N2)(C)C)c1cc(ccc1Cl)[N+](=O)[O-]

STK589912
Synonyms: 8-[4-(4-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-propyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccc(cc1)Cl

STK589913
Synonyms: (1'S,3R,3'S,7a'S)-1'-[(4-chlorophenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C

STK589914
Synonyms: N-[3-(diethylamino)propyl]-10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCN(CCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2)CC

STK589915
Synonyms: 4-(4-fluorophenyl)-N-(3-methoxyphenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)F

STK589916
Synonyms: (4E)-2-(2,3-dimethylphenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(c1C)C

STK589917
Synonyms: 5-(benzylamino)-10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(2H)-thione
Smiles: CC1CCc2c(C1)c1c(s2)nc(n2c1n[nH]c2=S)NCc1ccccc1

STK589918
Synonyms: 5-[(2,3-dimethoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: COc1c(cccc1OC)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK589919
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dimethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1COc1ccc(cc1)Cl

STK589920
Synonyms: N-{(1Z)-1-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]-1H-isoindol-3-yl}-4-nitrobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)[N+](=O)[O-])/C(=O)NC1CCCCC1

STK589921
Synonyms: (4E)-1-hexyl-4-[hydroxy(4-methylphenyl)methylidene]-5-phenylpyrrolidine-2,3-dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccccc1

STK589922
Synonyms: (5E)-3-benzyl-5-(1-{[3-(diethylamino)propyl]amino}propylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCN(CCCN/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/CC)CC

STK589923
Synonyms: 6-(4-methoxyphenyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccccc2)ncn3)C1)O

STK589924
Synonyms: N-[(2Z)-3-(1,3-benzodioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2

STK589926
Synonyms: (4Z)-4-[(3-chloro-4-methylphenyl)imino]-6-[(4-phenylpiperazin-1-yl)methyl]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1nc(CN2CCN(CC2)c2ccccc2)[nH]/c(=N/c2ccc(c(c2)Cl)C)/n1

STK589927
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-methoxyphenyl)carbonyl]-2'-[(3-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK589929
Synonyms: 5-(2-bromophenyl)-4-{[(E)-(3-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccc(c1)[N+](=O)[O-]

STK589930
Synonyms: 3,3-dimethyl-1-{[5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butan-2-one
Smiles: C=CCn1c(nnc1SCC(=O)C(C)(C)C)COc1ccccc1

STK589932
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-(4-hydroxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK589933
Synonyms: methyl4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STK589934
Synonyms: 2-chloro-7-(2-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Clc1ccc2c(c1)C1=C(CO2)C(n2c(N1)ncn2)c1ccccc1F

STK589935
Synonyms: (3a'S,6a'R)-5'-butyl-5-fluoro-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cc(F)cc2

STK589936
Synonyms: (4E)-5-[4-(benzyloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2ccc(cc2)OCc2ccccc2)N(C(=O)C1=O)c1nccs1)/O

STK589937
Synonyms: 5-[(2E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]-3-(4-ethoxyphenyl)-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCOc1ccc(cc1)n1c(O)nc(c(c1=O)C(=O)/C=C/c1cc(OC)ccc1OC)O

STK589939
Synonyms: (4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O)C

STK589941
Synonyms: 7-(4-benzylpiperidin-1-yl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3N1CCC(CC1)Cc1ccccc1)C

STK589942
Synonyms: 3-cyclopentyl-N-[(2Z)-3-(4-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: COc1ccc(cc1)CN1/C(=N/C(=O)CCC2CCCC2)/SC2C1CS(=O)(=O)C2

STK589944
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCCn1c[nH+]cc1)/[O-]

STK589946
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-methoxyphenyl)carbonyl]-3'-[(4-methylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK589947
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)N=C2C(=C(O)CCC2)C1c1ccco1

STK589948
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccc(cc1)C

STK589950
Synonyms: (2E)-3-(2-chlorophenyl)-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]prop-2-enamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C)/C=C/c1ccccc1Cl

STK589951
Synonyms: N-(4-chlorophenyl)-2-[(12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C

STK589952
Synonyms: 5-fluoro-3-hydroxy-3-[2-oxo-2-(pyridin-4-yl)ethyl]-1,3-dihydro-2H-indol-2-one
Smiles: Fc1ccc2c(c1)C(O)(CC(=O)c1ccncc1)C(=O)N2

STK589956
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CCCn1cnc2c(c1=O)cccc2

STK589957
Synonyms: 6-(4-methoxyphenyl)-10-methyl-3-(pyridin-4-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1cc1CN(COc1c2C)Cc1ccncc1

STK589959
Synonyms: 4-{[(E)-(4-bromophenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Br)C

STK589960
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STK589961
Synonyms: 8-{[2-(dimethylamino)ethyl]amino}-6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(NCCN(C)C)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK589962
Synonyms: (4Z)-4-[2-(3,4-dimethoxyphenyl)-4H-chromen-4-ylidene]-2-(4-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: COc1cc(ccc1OC)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)F)/c2c(O1)cccc2

STK589963
Synonyms: 5-(2-ethyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-2,6-dihydroxy-3-(4-iodophenyl)pyrimidin-4(3H)-one
Smiles: CCN1CCc2c(C1c1c(O)nc(n(c1=O)c1ccc(cc1)I)O)[nH]c1c2cccc1

STK589964
Synonyms: 7-(2,4-dichlorophenyl)-8-(2-ethylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCc1ccccc1n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1Cl)Cl

STK589966
Synonyms: 3-[(3-methoxybenzyl)sulfanyl]-5-(2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccccc1)c1ccccc1OC

STK589967
Synonyms: N-benzyl-2-{[6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: CSc1nc(SCC(=O)NCc2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK589968
Synonyms: N-[4-(7-methyl-5-oxo-1,3,4,5-tetrahydro-2H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-10(11H)-yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCCC2

STK589969
Synonyms: 8-[(4-ethylpiperazin-1-yl)methyl]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK589970
Synonyms: 2-methoxy-4-[(E)-{[3-(2-methoxyphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenylacetate
Smiles: COc1cc(ccc1OC(=O)C)/C=N/n1c(=S)[nH]nc1c1ccccc1OC

STK589971
Synonyms: 8-(4-benzylpiperidin-1-yl)-1,3-dimethyl-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccnc(n1)SCCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCC(CC1)Cc1ccccc1

STK589972
Synonyms: 2-[(2-hydroxypropyl)amino]-3-(4-methoxyphenyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(NCC(O)C)nc2c(c1=O)c1CCCCCc1s2

STK589974
Synonyms: 8-(4-benzylpiperidin-1-yl)-6-hydroxy-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1)COc1ccccc1C

STK589975
Synonyms: 6-hydroxy-8-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1ccccc1/C=N/Nc1nc2c(n1CCOc1ccccc1)c(O)nc(=O)n2C

STK589978
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(2-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK589980
Synonyms: 2-{[3-(dimethylamino)propyl]amino}-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CN(CCCNc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3)C

STK589981
Synonyms: N-benzyl-2-[3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-2-oxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetamide
Smiles: O=C(Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C)NCc1ccccc1

STK589982
Synonyms: N-(3-ethoxypropyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCOCCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK589983
Synonyms: 2,4-dichloro-N-[(1Z)-1-{1-cyano-2-[(3-methoxypropyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Smiles: COCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1Cl)Cl)/C#N

STK589984
Synonyms: (5Z)-3-benzyl-6-hydroxy-5-[(2-phenyl-1H-indol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C\c1c([nH]c2c1cccc2)c1ccccc1)Cc1ccccc1

STK589985
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2cccc(c2)OC)cc(c1)OC

STK589989
Synonyms: (3aR,6aS)-5-(5-chloro-2-methylphenyl)-3-(2,5-dimethoxyphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1ccc(cc1C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(Cl)ccc1C)OC

STK589990
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK589992
Synonyms: 3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-5-phenyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
Smiles: OCCCn1cnc2c(c1=N)C(c1ccccc1)C1=C(O2)CC(CC1=O)(C)C

STK589993
Synonyms: 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c1c2CCC1)NCCCN1CCCC1=O

STK589994
Synonyms: N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-4-methyl-N-(4-methylphenyl)benzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccc(cc1)C)c1ccc(cc1)C

STK589997
Synonyms: {(5S)-5-[(2-methoxy-5-nitrophenyl)carbamoyl]-3-[4-(prop-2-en-1-yloxy)phenyl]-4,5-dihydro-1,2-oxazol-5-yl}aceticacid
Smiles: C=CCOc1ccc(cc1)C1=NO[C@@](C1)(CC(=O)O)C(=O)Nc1cc(ccc1OC)[N+](=O)[O-]

STK589999
Synonyms: 1-(4-chlorophenyl)-4-(3-methoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cccc(c1)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)Cl

STK590002
Synonyms: 8-(3-methoxyphenyl)-1-methyl-3-(3-methylbutyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK590003
Synonyms: N,N-dibutyl-N'-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine
Smiles: CCCCN(CCCC)CCCNc1ncnc2c1[nH]c1c2cc(cc1)OCC

STK590004
Synonyms: N-[(2Z)-3-[4-(diethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: CCN(c1ccc(cc1)N1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2)CC

STK590005
Synonyms: 4-(4-fluorophenyl)-N,1-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)F

STK590008
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK590011
Synonyms: 4-(4-ethoxyphenyl)-3-[(4-nitrobenzyl)sulfanyl]-5-(thiophen-2-yl)-4H-1,2,4-triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccs1

STK590012
Synonyms: 4-[({[3-(4-ethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nc2c(c1=O)cccc2

STK590013
Synonyms: 7-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccn1)c1noc(c1)C

STK590016
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)Cl)Cl

STK590019
Synonyms: 9-(4-fluorophenyl)-1,3,7-trimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccc(cc2)F)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

STK590021
Synonyms: 9-(5-methyl-1,2-oxazol-3-yl)-8-[4-(prop-2-en-1-yloxy)phenyl]-8,9-dihydrobenzo[7,8]chromeno[2,3-c]pyrrole-7,10-dione
Smiles: C=CCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK590022
Synonyms: 4-({[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: C=CCn1c(SCc2ccc(cc2)C#N)nnc1c1cccc(c1)Cl

STK590023
Synonyms: (5E)-5-({[4-(diethylamino)phenyl]amino}methylidene)-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

STK590024
Synonyms: 4-[(2E)-2-{[5-(2-fluorophenyl)furan-2-yl]methylidene}hydrazinyl]benzoicacid
Smiles: Fc1ccccc1c1ccc(o1)/C=N/Nc1ccc(cc1)C(=O)O

STK590025
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK590026
Synonyms: 2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]-N-[2-(morpholin-4-yl)ethyl]propanamide
Smiles: O=C(C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C)NCCN1CCOCC1

STK590027
Synonyms: 5-cyclopropyl-N'-[(1E)-1-(4-hydroxy-3-methoxyphenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1cc(ccc1O)/C(=N/NC(=O)c1n[nH]c(c1)C1CC1)/C

STK590028
Synonyms: N-(2-methoxyethyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]methanesulfonamide
Smiles: COCCN(S(=O)(=O)C)Cc1cc2cc(C)ccc2[nH]c1=O

STK590029
Synonyms: 3-(3,5-dichloro-2-hydroxyphenyl)-5-(4-ethoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cc(Cl)cc(c1O)Cl

STK590030
Synonyms: 4-imino-9,10-dimethoxy-2-(thiophen-2-yl)-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1cccs1

STK590033
Synonyms: methyl4-{[({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK590034
Synonyms: N-[(2E)-5-ethyl-4-phenyl-1,3-thiazol-2(3H)-ylidene]-3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamide
Smiles: CCc1s/c(=N/C(=O)CCn2c(=O)sc3c2cccc3)/[nH]c1c1ccccc1

STK590035
Synonyms: 2-{4-[4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C

STK590036
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(1,3-benzodioxol-5-yl)-3'-benzyl-6-chloro-7-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@@H]2[C@H]1[C@H](Cc1ccccc1)N[C@@]12C(=O)Nc2c1ccc(c2C)Cl

STK590037
Synonyms: 4'-amino-1-butyl-9',10'-dimethoxy-2-oxo-1,2,6',7'-tetrahydrospiro[indole-3,2'-pyrido[2,1-a]isoquinoline]-3'-carbonitrile
Smiles: CCCCN1c2ccccc2C2(C1=O)C=C1N(C(=C2C#N)N)CCc2c1cc(OC)c(c2)OC

STK590038
Synonyms: N-(4-{(3E)-2-(4-chlorophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(c2ccc(cc2)Cl)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK590039
Synonyms: (2'S,3R,7a'S)-N-(4-fluorophenyl)-5-methyl-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-2'-carboxamide
Smiles: O=C([C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(C)cc1)CCC2)Nc1ccc(cc1)F

STK590040
Synonyms: 2-cyano-N-[(2Z)-3-(4-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)OC)CS(=O)(=O)C2

STK590041
Synonyms: 2-[(2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)cc2)C)NCc1cccnc1

STK590042
Synonyms: 4-{(2E)-2-[(5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylidene]hydrazinyl}-5-phenylthieno[2,3-d]pyrimidine
Smiles: COc1ccc2c(c1)c(/C=N/Nc1ncnc3c1c(cs3)c1ccccc1)c(n2C)C

STK590044
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[4-(methoxycarbonyl)phenyl]-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene}methanolate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STK590045
Synonyms: 2,7,7-trimethyl-1-(pyridin-3-ylmethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Smiles: CC1=NC(C2=C(N1Cc1cccnc1)CC(CC2=O)(C)C)(C(F)(F)F)C(F)(F)F

STK590046
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK590047
Synonyms: 1',3'-dimethyl-8-nitro-3-propanoyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N(C)C(=O)N(C1=O)C

STK590051
Synonyms: 2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)NCCc1ccccc1)nn2)CC(OC3)(C)C

STK590054
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cccc2C)nnc1c1cccc(c1)Cl

STK590055
Synonyms: N-(1,3-benzodioxol-5-yl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1ccccc1

STK590059
Synonyms: (5Z)-5-(2,4-dichlorobenzylidene)-2-[(4-hydroxyphenyl)(methyl)amino]-1,3-thiazol-4(5H)-one
Smiles: Oc1ccc(cc1)N(C1=NC(=O)/C(=C/c2ccc(cc2Cl)Cl)/S1)C

STK590060
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1cc(ccc1OCc1ccccc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)C

STK590062
Synonyms: 4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1Br

STK590063
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1COc1ccc(cc1)C

STK590066
Synonyms: ethyl(3R)-2'-amino-5-fluoro-1-methyl-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c([C@@]31c1cc(F)ccc1N(C3=O)C)c(=O)oc1c2cccc1

STK590067
Synonyms: 5-{[(2-chlorobenzyl)sulfanyl](prop-2-en-1-ylamino)methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: C=CCNC(=C1C(=O)N(C)C(=O)N(C1=O)C)SCc1ccccc1Cl

STK590068
Synonyms: 3-[(4-tert-butylbenzyl)sulfanyl]-5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1cccc(c1)Cl

STK590069
Synonyms: (2S)-N-[4-(acetylamino)phenyl]-3-methyl-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)[C@@H](n1cnc2c(c1=O)cccc2)C(C)C

STK590070
Synonyms: 2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccc(cc1)C

STK590072
Synonyms: 8-{[bis(2-methylpropyl)ammonio]methyl}-3-(3-methylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: CC(C[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)Oc1cccc(c1)C)C(F)(F)F)CC(C)C)C

STK590073
Synonyms: 13-(4-chlorophenyl)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccc(cc2)Cl)C2=C1CC(CC2=O)(C)C

STK590074
Synonyms: 11-(2-methoxyphenyl)-3-methyl-2,3,4,11-tetrahydrodibenzo[b,e][1,4]thiazepin-1-ol
Smiles: COc1ccccc1C1Sc2ccccc2N=C2C1=C(O)CC(C2)C

STK590075
Synonyms: 5-[1-{[(4-fluorophenyl)amino]acetyl}-5-(4-methoxyphenyl)pyrazolidin-3-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)C1CC(=C2C(=O)N(C)C(=O)N(C2=O)C)NN1C(=O)CNc1ccc(cc1)F

STK590078
Synonyms: N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-6-methoxy-1H-indole-2-carbohydrazide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N/N=C/c1ccc(cc1O)O

STK590079
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK590080
Synonyms: 7-chloro-1-(2,3-dimethoxyphenyl)-6-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)cccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK590082
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nnc1c1cccc(c1)Cl

STK590083
Synonyms: (5E)-1-cyclopropyl-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NCCN1CCNCC1)C1CC1

STK590085
Synonyms: (3a'S,6a'R)-6-chloro-5'-cyclopentyl-7-methyl-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCC1)C(=O)Nc1c2ccc(c1C)Cl

STK590086
Synonyms: 2-chloro-N'-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2Cl)/C1=O)S

STK590087
Synonyms: N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-L-phenylalanine
Smiles: O=C(C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)N[C@H](C(=O)O)Cc1ccccc1

STK590088
Synonyms: 2,2,5-trimethyl-N-[4-(propan-2-yloxy)benzyl]-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CC(Oc1ccc(cc1)CNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)C

STK590089
Synonyms: 3-butyl-8-(3-chlorophenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)Cl

STK590092
Synonyms: N-(3-hydroxypropyl)-2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]propanamide
Smiles: OCCCNC(=O)C(Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)C

STK590093
Synonyms: 3-(3-chlorophenyl)-2-{[3-(dimethylamino)propyl]amino}-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CN(CCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCCCC3)C

STK590095
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-fluoro-4-methoxyphenyl)carbonyl]-3'-[(3-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(c(c1)F)OC)C(=O)Nc1c2cccc1)cccc3

STK590097
Synonyms: (1Z)-5-(2,4-dichlorophenoxy)-1-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)pentan-2-one
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)CCCOc1ccc(cc1Cl)Cl

STK590098
Synonyms: 6-(4-methoxyphenyl)-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cccnc2)ncn3)C1)O

STK590100
Synonyms: 7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl{[(4-methylphenyl)sulfonyl]amino}(phenyl)acetate
Smiles: O=C(C(c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)Oc1cc(C)cc2c1c1CCCc1c(=O)o2

STK590101
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1F

STK590102
Synonyms: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C

STK590104
Synonyms: 1-amino-2-(4-methylpiperazin-1-yl)-4-(propan-2-ylamino)anthracene-9,10-dione
Smiles: CN1CCN(CC1)c1cc(NC(C)C)c2c(c1N)C(=O)c1c(C2=O)cccc1

STK590106
Synonyms: 8-ethyl-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: CCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK590107
Synonyms: [1-(3-fluorophenyl)cyclopentyl](7-methylidene-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: Fc1cccc(c1)C1(CCCC1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCCCO1

STK590108
Synonyms: 5-(3,4-dichlorophenyl)-N'-[(E)-thiophen-2-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)N/N=C/c1cccs1

STK590109
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(4-nitrophenyl)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK590111
Synonyms: (1E)-1-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)-4,4,6,8-tetramethyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Smiles: SC1=NC(=O)/C(=C/2\c3cc(C)cc4c3N(C2=O)C(C)(C)CC4C)/C(=N1)O

STK590113
Synonyms: (2Z)-N-(4-fluorophenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanamide
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)Nc1ccc(cc1)F

STK590114
Synonyms: 5-bromo-N-(3-methoxypropyl)-3-methyl-1H-indole-2-carboxamide
Smiles: COCCCNC(=O)c1[nH]c2c(c1C)cc(cc2)Br

STK590116
Synonyms: 5-(4-methoxybenzyl)-N-[(2E)-4,6,7-trimethylquinazolin-2(1H)-ylidene]-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)CN1CNC(=NC1)/N=c\1/nc(C)c2c([nH]1)cc(c(c2)C)C

STK590117
Synonyms: 2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK590118
Synonyms: 2-[5-(2,5-dichlorophenyl)furan-2-yl]-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc(OC)c(c1)OC)c1ccc(o1)c1cc(Cl)ccc1Cl

STK590119
Synonyms: 4-{[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]amino}-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1nn(c(c1/C=N/n1c(=S)[nH]nc1c1cccnc1)C)c1ccccc1

STK590121
Synonyms: 3-amino-N-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: COc1cc(ccc1OC)C1C2=C(O)CC(CC2=Nc2c1c(N)c(s2)C(=O)Nc1ccccc1Cl)(C)C

STK590122
Synonyms: 2-(2-methoxyphenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]propanamide
Smiles: COc1ccccc1OC(C(=O)Nc1onc(c1)c1ccc(cc1)C)C

STK590123
Synonyms: 6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(nc2c1c(O)nc(=O)n2C)N1N=C(CC1=O)C

STK590124
Synonyms: (3S,3'S,3a'R,6a'S)-5-bromo-3'-(propan-2-yl)-5'-(prop-2-en-1-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: C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2C(C)C)C(=O)Nc2c1cc(Br)cc2

STK590125
Synonyms: 3-benzyl-1',3'-diethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1C(=O)N(CC)C(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)Cc1ccccc1

STK590126
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK590127
Synonyms: N-(3,5-dimethoxyphenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2Cc2ccco2)COc2ccccc2)cc(c1)OC

STK590128
Synonyms: 7-(3,4-dichlorophenyl)-3-(thiophen-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(cc1Cl)n1ncc2c1ncn1c2nnc1c1cccs1

STK590129
Synonyms: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1CC(=O)c1ccccc1)c(=O)n(c(=O)n2C)C

STK590130
Synonyms: 2-[(2-hydroxypropyl)amino]-3-(2-phenylethyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(CNc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCCC3)O

STK590131
Synonyms: (2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1-(5-methylfuran-2-yl)ethanone
Smiles: Cc1ccc(o1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2

STK590132
Synonyms: 5-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1cc(ccc1OCc1ccccc1)c1[nH]nc(c1)C(=O)N/N=C/c1c(O)ccc2c1cccc2

STK590134
Synonyms: 4-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzenesulfonamide
Smiles: CCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2cc(C)ccc2[nH]c1=O

STK590136
Synonyms: (1'R,2'S)-1'-[(4-chlorophenyl)carbonyl]-2'-(2-fluorophenyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccccc1F)C(=O)c1c(C2=O)cccc1)C

STK590137
Synonyms: N-(4-bromo-3-methylphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1c1ccccc1)c1nccnc1

STK590138
Synonyms: 7-bromo-1-(3-methoxy-4-propoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1ccc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK590139
Synonyms: 8-[(3-chlorophenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Clc1cccc(c1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK590140
Synonyms: methyl4-{(3E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK590142
Synonyms: 7-benzyl-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK590144
Synonyms: 5,6-dimethoxy-N-(1-phenylethyl)-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NC(c1ccccc1)C

STK590145
Synonyms: (3E)-3-{2-oxo-2-[4-(prop-2-en-1-yloxy)phenyl]ethylidene}-1,3-dihydro-2H-indol-2-one
Smiles: C=CCOc1ccc(cc1)C(=O)/C=C\1/C(=O)Nc2c1cccc2

STK590147
Synonyms: 2-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OC

STK590148
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2F)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK590149
Synonyms: 2-(4-chlorophenyl)-3-[2-(2-phenoxyethoxy)ethyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccccc1

STK590150
Synonyms: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1c1cccc(c1)C

STK590151
Synonyms: 6-amino-4-(3-ethoxy-4-methoxyphenyl)-3-(furan-2-yl)-1,4-dihydrothiopyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(ccc1OC)C1C(=C(N)Sc2c1c(n[nH]2)c1ccco1)C#N

STK590152
Synonyms: 3-[(4-nitrobenzyl)sulfanyl]-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Smiles: Nn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cc([nH]n1)c1ccccc1

STK590155
Synonyms: 7,7-dimethyl-2-(4-methylphenyl)-4-{[2-(piperidin-1-yl)ethyl]sulfanyl}-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: Cc1ccc(cc1)c1nc(SCCN2CCCCC2)c2c(n1)CC(OC2)(C)C

STK590157
Synonyms: 4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc2c(c1/C=N/n1c(=S)[nH]nc1c1cccc(c1)C)cccc2

STK590158
Synonyms: (8Z)-8-[(2E)-(2-hydroxybenzylidene)hydrazinylidene]-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: C=CCn1/c(=N\N=C\c2ccccc2O)/[nH]c2c1c(=O)n(c(=O)n2C)C

STK590159
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-6-(3-chloro-4-fluorophenyl)-3-(3-nitrophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1[C@@H]2[C@H]3C[C@@H]([C@@H]2C(=O)N1c1ccc(c(c1)Cl)F)[C@@H]1[C@H]3C(=NO1)c1cccc(c1)[N+](=O)[O-]

STK590163
Synonyms: 2-chloro-4-methyl-1,3-thiazole-5-carboxylicacid
Smiles: Clc1nc(c(s1)C(=O)O)C

STK590164
Synonyms: 7-(2-methylphenyl)-14H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: Cc1ccccc1c1nc2oc3ccccc3c(=O)c2c2n1c1ccccc1n2

STK590165
Synonyms: 10-(4-chlorobenzyl)-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one
Smiles: Clc1ccc(cc1)CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCCC2

STK590170
Synonyms: 2-{[5-tert-butyl-3-(4-chlorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-1-(2-ethoxyphenyl)ethanone
Smiles: CCOc1ccccc1C(=O)CSc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK590171
Synonyms: (5E)-2,6-dihydroxy-5-(1-{[1-(1H-indol-3-yl)butan-2-yl]amino}ethylidene)pyrimidin-4(5H)-one
Smiles: CCC(Cc1c[nH]c2c1cccc2)N/C(=C/1\C(=NC(=NC1=O)O)O)/C

STK590172
Synonyms: 16-(4-tert-butylphenyl)-3,3-dimethyl-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1OCCCOc1c2)c1ccc(cc1)C(C)(C)C

STK590173
Synonyms: 4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl)C

STK590174
Synonyms: 7-(4-methoxyphenyl)-3-(4-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)[N+](=O)[O-]

STK590175
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK590176
Synonyms: 7-methyl-3-[(3-methylbutyl)amino]-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: N#Cc1c(NCCC(C)C)nc(c2c1CCN(C2)C)N1CCCC1

STK590179
Synonyms: 4-hydroxy-1,6,7-trimethyl-8-(3-methylphenyl)-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Cc1cccc(c1)n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK590180
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc(cc1)c1ccccc1)c1ccncc1

STK590182
Synonyms: 6,8-dibromo-2,4-dihydroxy-N-[3-(morpholin-4-yl)propyl]quinoline-3-carboxamide
Smiles: Brc1cc(Br)c2c(c1)c(O)c(c(n2)O)C(=O)NCCCN1CCOCC1

STK590184
Synonyms: methyl[1-(3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)-3-oxopiperazin-2-yl]acetate
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCNC(=O)C2CC(=O)OC)/C1=O)C

STK590185
Synonyms: 3-(4-fluorophenyl)-5-pentyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylhexanoate
Smiles: CCCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCCC)cccc3)c1ccc(cc1)F

STK590187
Synonyms: N-[(2E)-5-[(4-fluorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]naphthalene-1-carboxamide
Smiles: Fc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N\C(=O)c2cccc3c2cccc3)/s1

STK590188
Synonyms: (1'R,2'R)-1'-(2,2-dimethylpropanoyl)-7'-methyl-2'-(4-methylphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Cc1ccc(cc1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C

STK590190
Synonyms: N-(3,4-dichlorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK590191
Synonyms: 7-(benzylsulfanyl)-11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCc1ccccc1)nn2

STK590195
Synonyms: 8-(4-butylphenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCCCc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC=C

STK590197
Synonyms: N-(4-{[(3E)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]sulfamoyl}phenyl)acetamide
Smiles: CCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)NC(=O)C)/c2c1nc1cc(C)ccc1c2

STK590198
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN(c2ccccc2)C)c2nonc2N)cc(c1O)OC

STK590200
Synonyms: (3R)-6,7-dimethoxy-5-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COc1c(OC)ccc2c1C(=O)N1C2SC[C@H]1C(=O)NC1CC(C)(C)NC(C1)(C)C

STK590201
Synonyms: 5-butyl-3-(4-chlorobenzyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylpentanoate
Smiles: CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)Cc1ccc(cc1)Cl

STK590203
Synonyms: ethyl(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetate
Smiles: CCOC(=O)C(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK590204
Synonyms: (3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-5-methyl-5'-(4-methylphenyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Cc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)C)Cc1c[nH]c3c1cccc3)C(=O)N2

STK590205
Synonyms: N-[(2E)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK590207
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2cccc(c2)Cl)cc(c1OC)OC

STK590212
Synonyms: 6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[4-(propan-2-yl)phenyl]hexanamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CCCCCn1nnc2c(c1=O)cccc2

STK590214
Synonyms: 8-(cyclohexylamino)-6-hydroxy-3-methyl-7-pentyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCn1c(NC2CCCCC2)nc2c1c(O)nc(=O)n2C

STK590215
Synonyms: 9-chloro-5-(2-methoxyphenyl)-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccccc1C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)C)Cl

STK590217
Synonyms: 5-(1-acetyl-5-phenylpyrazolidin-3-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CC(=O)N1NC(=C2C(=O)N(C)C(=O)N(C2=O)C)CC1c1ccccc1

STK590218
Synonyms: (8Z)-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-1,3-dimethyl-8-[(2Z)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)OCC(Cn1/c(=N\N=C\2/C(=O)Nc3c2cccc3)/[nH]c2c1c(=O)n(C)c(=O)n2C)O

STK590220
Synonyms: 3-(2-chlorophenyl)-5-[(2-fluorobenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2F)nnc1c1ccccc1Cl

STK590222
Synonyms: 5-{[(2Z)-3-(4-methylbenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1Cc1ccc(cc1)C)CS(=O)(=O)C2

STK590225
Synonyms: N-(4-chlorobenzyl)-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: O=C(CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCc1ccc(cc1)Cl

STK590226
Synonyms: 2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK590227
Synonyms: 2-{[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}ethanol
Smiles: OCCSc1ncnc2c1sc1c2c2CCCc2c(n1)CC(C)C

STK590229
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Oc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK590230
Synonyms: (2Z)-N-benzyl-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanamide
Smiles: COc1cc2/C(=C/C(=O)NCc3ccccc3)/NCCc2cc1OC

STK590233
Synonyms: N-[4-(6-chloro-3,4-dimethyl-2-oxo-2H,8H-chromeno[8,7-e][1,3]oxazin-9(10H)-yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1COc2c(C1)c1oc(=O)c(c(c1cc2Cl)C)C

STK590235
Synonyms: (3a'S,6a'R)-5'-butyl-7-chloro-3'-(3,4-dihydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cccc2Cl

STK590236
Synonyms: N-(furan-2-ylmethyl)-3-methoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)Cc1ccco1

STK590237
Synonyms: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(furan-2-yl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: COc1ccc(cc1OC)CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccco1

STK590238
Synonyms: 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-[2-(morpholin-4-yl)ethyl]propanamide
Smiles: O=C(C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)C)NCCN1CCOCC1

STK590240
Synonyms: N-[(2Z)-3-(4-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: COc1ccc(cc1)N1/C(=N/C(=O)CC(C)C)/SC2C1CS(=O)(=O)C2

STK590241
Synonyms: 1-(3,4-dimethoxyphenyl)-2-(6-methoxy-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(c(c1)OC)OC)c(=O)c1c(o2)cccc1

STK590242
Synonyms: (3a'S,6a'R)-5'-(3-bromophenyl)-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Brc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

STK590243
Synonyms: N-[3-(4-chlorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]acetamide
Smiles: CC(=O)Nc1c(c2ccc(cc2)Cl)c(=O)c2c(n1C)cccc2

STK590245
Synonyms: (1S)-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}ethanamine
Smiles: Cc1ccc(cc1)CSc1nnc(o1)[C@@H](N)C

STK590246
Synonyms: (2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)Nc1ccc2c(c1)OCCO2

STK590248
Synonyms: N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-L-leucyl-L-alanine
Smiles: CC(C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C

STK590250
Synonyms: 4-(9-hydroxy-7,7-dimethyl-11-oxo-7,8,10,11-tetrahydro-6H-indeno[1,2-b]quinolin-10-yl)phenyl4-chlorobenzoate
Smiles: Clc1ccc(cc1)C(=O)Oc1ccc(cc1)C1C2=C(O)CC(CC2=NC2=C1C(=O)c1c2cccc1)(C)C

STK590251
Synonyms: N-(2-ethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK590252
Synonyms: 4-({[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK590253
Synonyms: 4-{[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]amino}-5-(4-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(OC)c(c(c1)OC)O

STK590256
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(/C=C/C(=C/2\C(=NC(=O)N(C2=O)c2ccccc2OC)O)/O)ccc1O

STK590257
Synonyms: ethyl5'-{[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}-2,3'-bithiophene-4'-carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NC(=NC2=O)S)O)scc1c1cccs1

STK590260
Synonyms: 3-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(nc2c(c1=O)c1CCCCCc1s2)N1CCN(CC1)C

STK590261
Synonyms: (2E)-1-(2,4-dinitrophenyl)-2-[2-(2-methylpentan-2-yl)cyclohexylidene]hydrazine
Smiles: CCCC(C1CCCC/C/1=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])(C)C

STK590263
Synonyms: 5,11-dimethyl-2-(pyridin-3-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1CCCc2c1c1c(s2)nc(n2c1nc(n2)c1cccnc1)C

STK590264
Synonyms: 2-(3-bromo-5-ethoxy-4-hydroxyphenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCOc1cc(cc(c1O)Br)c1cc2c3cc(OC)c(cc3CCn2c(=N)c1C#N)OC

STK590265
Synonyms: benzyl{[7-(2-ethoxyethyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]sulfanyl}acetate
Smiles: CCOCCn1c(SCC(=O)OCc2ccccc2)nc2c1c(O)nc(=O)n2C

STK590266
Synonyms: (2Z)-2-[(2E)-benzylidenehydrazinylidene]-4-hydroxy-N-phenyl-5,6-dihydro-2H-1,3-thiazine-6-carboxamide
Smiles: OC1=N/C(=N/N=C/c2ccccc2)/SC(C1)C(=O)Nc1ccccc1

STK590267
Synonyms: 2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cn1c(O)nc2c(c1=O)cccc2

STK590271
Synonyms: 2-(4-ethoxyphenyl)-4-imino-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCOc1ccc(cc1)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

STK590272
Synonyms: 1-(4-chlorophenyl)-2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: Cc1ccc(cc1)OCc1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)Cl

STK590273
Synonyms: N-hexyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline-8(7H)-carbothioamide
Smiles: CCCCCCNC(=S)N1CCc2c(C1)cc1c(c2)OCCCO1

STK590274
Synonyms: (5E)-3-benzyl-5-(1-{[4-(dimethylamino)phenyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\Nc2ccc(cc2)N(C)C)/C)/C(=O)N1Cc1ccccc1

STK590276
Synonyms: (4-benzylpiperidin-1-yl)(4,5,6,7-tetrahydro-2H-indazol-3-yl)methanone
Smiles: O=C(c1[nH]nc2c1CCCC2)N1CCC(CC1)Cc1ccccc1

STK590277
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK590278
Synonyms: N-[2-({(1Z)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}amino)phenyl]propanamide
Smiles: C=CCN1C(=O)N=C(/C(=C(/Nc2ccccc2NC(=O)CC)\C)/C1=O)O

STK590280
Synonyms: 1-tert-butyl4-(4-ethyl-2-oxo-2H-chromen-7-yl)piperidine-1,4-dicarboxylate
Smiles: CCc1cc(=O)oc2c1ccc(c2)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK590281
Synonyms: 2-(benzylsulfanyl)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2cccc(c2)[N+](=O)[O-])nc(n3)SCc2ccccc2)CCC1

STK590283
Synonyms: 5-(4-chlorophenyl)-10-(2-fluorophenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Clc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccccc1F

STK590284
Synonyms: 5-(4-ethoxyphenyl)-4-methyl-N'-[(E)-pyridin-4-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: CCOc1ccc(cc1)c1[nH]nc(c1C)C(=O)N/N=C/c1ccncc1

STK590285
Synonyms: N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1ccc(cc1)F

STK590286
Synonyms: N-(4-methoxyphenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cn1nnc2c(c1=O)cccc2

STK590287
Synonyms: 7-hydrazinyl-2-methyl-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
Smiles: CCCc1cc(NN)n2c(n1)c(c1ccccc1)c(n2)C

STK590293
Synonyms: N-(furan-2-ylmethyl)-4,5,6-trimethoxy-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)NCc1ccco1

STK590294
Synonyms: N-(4-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]pyridine-3-carboxamide
Smiles: Cc1ccc(cc1)N(C(=O)c1cccnc1)Cc1cc(=O)[nH]c2c1cccc2

STK590295
Synonyms: (3a'S,6a'R)-5'-butyl-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2

STK590296
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(N/N=C/2\C(=O)Nc3c2cccc3)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK590297
Synonyms: 3-(3-methoxypropyl)-10-methyl-2-(propan-2-yl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C(C)C

STK590298
Synonyms: 3-[4-(methoxycarbonyl)phenoxy]-4-oxo-8-(pyrrolidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: COC(=O)c1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCC1)[O-]

STK590299
Synonyms: (5,6-dimethoxy-1H-indol-2-yl)[4-(2-fluorophenyl)piperazin-1-yl]methanone
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)N1CCN(CC1)c1ccccc1F

STK590300
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(diethylamino)phenyl]acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1)CC

STK590301
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,4-dimethylphenyl)-5-ethyl-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: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)C

STK590302
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK590303
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(4-ethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)OCC)/C2=O)CCOC

STK590304
Synonyms: N-{4-[(3a'S,6a'R)-7-chloro-3'-(1H-indol-3-ylmethyl)-5-methyl-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(C)cc2Cl

STK590305
Synonyms: 4-{[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/C=C/c1ccco1)c1ccccn1

STK590308
Synonyms: 2-{2-[(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)amino]ethoxy}ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK590309
Synonyms: 3-tert-butyl-7-(3-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1cccc(c1)n1ncc2c1ncn1c2nnc1C(C)(C)C

STK590310
Synonyms: 3-(2-methoxyethyl)-10-methyl-2-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCc1nc2c(c(=O)n1CCOC)c(=O)c1c(n2C)cccc1

STK590311
Synonyms: 4-[10-(4-fluorophenyl)-2,6,8-trioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2ccc(cc2)F)sc(=O)[nH]1

STK590313
Synonyms: 4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCC1CCCO1

STK590315
Synonyms: N-[(2Z)-5,5-dioxido-3-[2-(trifluoromethyl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]tetrahydrofuran-2-carboxamide
Smiles: O=C(C1CCCO1)/N=C/1\SC2C(N1c1ccccc1C(F)(F)F)CS(=O)(=O)C2

STK590316
Synonyms: 6-chloro-7-methyl-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cc(c(c2)Cl)C)/N=c\1/[nH]c2c(s1)cc(cc2)S(=O)(=O)C

STK590318
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)OC

STK590319
Synonyms: 10a-[(E)-2-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1

STK590320
Synonyms: 5-methoxy-N'-[(E)-(3-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2)OC

STK590321
Synonyms: 4-chloro-N-[3-(2-fluorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1F

STK590323
Synonyms: 1'-butyl-3-hexyl-6-hydroxy-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCCCCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2CCC)CCCC)[N+](=O)[O-])O

STK590324
Synonyms: 10-(2-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Oc1ccccc1C1OCC(n2c1c1c(c2c2cccc(c2)[N+](=O)[O-])c(=O)n(c(=O)n1C)C)(C)C

STK590325
Synonyms: 2-(2-chlorophenyl)-N-[(2E)-3-(3-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1cccc(c1)F)CS(=O)(=O)C2)Cc1ccccc1Cl

STK590328
Synonyms: methylN-{[3-(1,3-benzoxazol-2-yl)phenyl]carbamoyl}-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1cccc(c1)c1nc2c(o1)cccc2

STK590329
Synonyms: 1-(3-bromophenyl)-2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2cccc(c2)Br)nnc1c1cccc(c1)Cl

STK590330
Synonyms: N-[(2Z)-3-(5-chloro-2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1cc(OC)c(cc1N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2)Cl

STK590332
Synonyms: N-(2-methylpropyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC(CNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2)C

STK590333
Synonyms: 9-(4-ethoxy-3-methoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCOc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK590334
Synonyms: 2-(4-chlorophenyl)-5,6,10,11-tetrahydro-9H-[1,4]dioxepino[2,3-g]pyrrolo[2,1-a]isoquinoline
Smiles: Clc1ccc(cc1)c1cn2c(c1)c1cc3OCCCOc3cc1CC2

STK590335
Synonyms: N-(2,5-dichlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1COc1ccccc1

STK590336
Synonyms: 3-(4-methoxyphenyl)-4-phenyl-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1cccc(c1)C(F)(F)F

STK590337
Synonyms: ethyl(2E)-2-{[(2Z)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N/C(=O)/C(=C\c2ccc(cc2)Cl)/C#N)/[nH]c1C

STK590338
Synonyms: 7-fluoro-1-phenyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)Cc1cccnc1

STK590340
Synonyms: N-(4-acetylphenyl)-2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK590341
Synonyms: 10-(4-chlorophenyl)-9-hydroxy-7,7-dimethyl-6,7,8,10-tetrahydro-11H-indeno[1,2-b]quinolin-11-one
Smiles: Clc1ccc(cc1)C1C2=C(O)CC(CC2=NC2=C1C(=O)c1c2cccc1)(C)C

STK590342
Synonyms: 1-[3-(benzyloxy)phenyl]-7-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccc(c1)OCc1ccccc1)c1noc(c1)C

STK590343
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK590344
Synonyms: 1'-benzyl-2'-hydroxy-3-nitro-6a,7,8,9,10,11-hexahydro-4'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: OC1=NC(=O)C2(C(=O)N1Cc1ccccc1)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]

STK590346
Synonyms: N-(2-{2-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1H-indol-3-yl}ethyl)-N-methylacetamide
Smiles: CC(=O)N(CCc1c(C=C2C(=O)N(C)C(=O)N(C2=O)C)[nH]c2c1cccc2)C

STK590348
Synonyms: 3-cyclohexyl-5-pentyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylhexanoate
Smiles: CCCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCCC)cccc3)C1CCCCC1

STK590349
Synonyms: N-[2',6'-dihydroxy-3-(2-methoxyphenyl)-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccc2OC)C(=NC(=NC1=O)O)O

STK590350
Synonyms: 1-{4-[(4-chlorobenzyl)oxy]phenyl}-7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)OCc1ccc(cc1)Cl)c(=O)c1c(o2)ccc(c1)C

STK590351
Synonyms: 1-benzyl-2-hydroxy-6-propyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2Cc1ccccc1)O

STK590352
Synonyms: 7-chloro-1-(2-fluorophenyl)-2-(2-phenylethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1F)CCc1ccccc1

STK590353
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(2-fluorophenyl)-1-(furan-2-ylmethyl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1ccco1)/O

STK590355
Synonyms: (4Z)-4-[2-(benzyloxy)benzylidene]-2-(2,4-dichlorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Clc1ccc(c(c1)Cl)C1=N/C(=C\c2ccccc2OCc2ccccc2)/C(=O)O1

STK590356
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK590358
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}biphenyl-2-carboxamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1ccccc1c1ccccc1)nn2)C(F)(F)F

STK590359
Synonyms: (3R)-2,2-dimethyl-N-[(2S)-1-(4-methylpiperazin-1-yl)-1-oxopropan-2-yl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CN1CCN(CC1)C(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK590360
Synonyms: ethyl3-{[(2S)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)[C@@H](n1cnc2c(c1=O)cccc2)C

STK590361
Synonyms: 5-(4-methoxyphenyl)-1,3-dimethyl-10-(1-methyl-1H-indol-3-yl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1cn(c2c1cccc2)C

STK590363
Synonyms: (E)-N-{[11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-(4-methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK590364
Synonyms: N-[3-methyl-1-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)-1-oxobutan-2-yl]benzamide
Smiles: CC(C(C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)NC(=O)c1ccccc1)C

STK590365
Synonyms: N-(butan-2-yl)-2-(9-methoxy-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: CCC(NC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)OC)C

STK590366
Synonyms: 1,7,8-trimethyl-3-(3-phenylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1n(CCCc2ccccc2)c(=O)c2c(n1C)nc1n2cc(n1C)C

STK590367
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK590370
Synonyms: 4-[(2E)-2-(2,4,5-trimethoxybenzylidene)hydrazinyl]-5H-pyrimido[5,4-b]indole
Smiles: COc1cc(OC)c(cc1/C=N/Nc1ncnc2c1[nH]c1c2cccc1)OC

STK590371
Synonyms: 4-{[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/Cl

STK590372
Synonyms: N-cycloheptyl-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: O=C(NC1CCCCCC1)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK590375
Synonyms: 4-(4-oxoquinazolin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCCn1cnc2c(c1=O)cccc2

STK590376
Synonyms: 2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK590377
Synonyms: N-(2-methoxy-5-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1COc1ccccc1

STK590378
Synonyms: 8-hydroxy-3,6-bis(4-methoxyphenyl)-9-phenyl-3,4,5,6,7,9-hexahydroacridin-1(2H)-one
Smiles: COc1ccc(cc1)C1CC(=C2C(=NC3=C(C2c2ccccc2)C(=O)CC(C3)c2ccc(cc2)OC)C1)O

STK590379
Synonyms: N-(4-bromo-3-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C)Br)nnc1c1ccccn1

STK590380
Synonyms: (4E)-4-[hydroxy(thiophen-2-yl)methylidene]-5-phenyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: C=CCSc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2cccs2)\O)/C(=O)C1=O

STK590381
Synonyms: 4-({(E)-[3-(benzyloxy)phenyl]methylidene}amino)-5-(2-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccc(c1)OCc1ccccc1

STK590382
Synonyms: 2-(4-chlorophenyl)-7-(2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1C

STK590384
Synonyms: N-ethyl-4-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2cc(C)ccc2[nH]c1=O

STK590385
Synonyms: 4-amino-5'-fluoro-2'-oxo-1',2',6,7-tetrahydrospiro[1,3-dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc(F)cc1)cc1c(c3)OCO1

STK590387
Synonyms: N-[(2E)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1CC(=O)/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK590388
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]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/c1ccc(cc1)OCc1ccccc1

STK590389
Synonyms: (4Z)-2-(5-chloro-2-methoxyphenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C\1/c2ccccc2C(=O)N(C1=O)c1cc(Cl)ccc1OC

STK590391
Synonyms: 8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1N1CCN(CC1)Cc1nc2c(n1CCN1CCOCC1)c(=O)n(c(=O)n2C)C

STK590392
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK590394
Synonyms: N-cyclohexyl-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-4-nitrobenzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])C1CCCCC1

STK590396
Synonyms: (3a'S,6a'R)-5'-(4-fluorobenzyl)-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: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cccc2

STK590397
Synonyms: benzyl[(3-cyano-6-hydroxy-4-phenyl-4,5-dihydropyridin-2-yl)sulfanyl]acetate
Smiles: N#CC1=C(SCC(=O)OCc2ccccc2)N=C(CC1c1ccccc1)O

STK590398
Synonyms: 7-fluoro-2-(pyridin-2-yl)-1-(2,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(OC)c(cc1C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F)OC

STK590400
Synonyms: 3-(2-methoxyphenyl)-5-[(2-methylbenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCc1ccccc1C

STK590401
Synonyms: [2-({(2'S,3S,3'S,10b'R)-2'-[(4-methoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)OC)C(=O)Nc1c2cccc1)cccc3

STK590402
Synonyms: 2-{8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetamide
Smiles: NC(=O)Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK590403
Synonyms: (2Z)-N-(furan-2-ylmethyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanamide
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)NCc1ccco1

STK590404
Synonyms: 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK590406
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dimethoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1COc1ccc(cc1)Cl

STK590409
Synonyms: 3-[11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]naphthalen-2-ol
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cc2ccccc2cc1O)c1ccccc1

STK590410
Synonyms: N-(2,4-difluorophenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK590411
Synonyms: 7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1noc(c1)C

STK590413
Synonyms: 8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: O=C(c1ccco1)N1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O

STK590416
Synonyms: (3S)-N-{(2S)-3-methyl-1-oxo-1-[(1-phenylethyl)amino]butan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: CC([C@@H](C(=O)NC(c1ccccc1)C)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK590418
Synonyms: 1-{7-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1nc3c([nH]1)cccc3)c(=O)n(c(=O)n2C)C

STK590419
Synonyms: 8-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-fluorobenzyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)CCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STK590420
Synonyms: 1-(4-methoxyphenyl)-7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK590422
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2,4-dichlorophenyl)carbonyl]-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1Cl)Cl)C(=O)Nc1c2cccc1)cccc3)C

STK590423
Synonyms: (4E)-1-butyl-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(2,4-dimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(cc1OC)OC

STK590424
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK590425
Synonyms: 1,7-dimethyl-8-(3-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cccc(c1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK590426
Synonyms: 4-(4-chlorophenyl)-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(cc1)Cl

STK590427
Synonyms: 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK590428
Synonyms: 5-(2-hydroxy-5-methylphenyl)-N-(pyridin-3-yl)-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1cccnc1)O

STK590429
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
Smiles: O=C1Nc2c(C1)cc(cc2)S(=O)(=O)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK590430
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(pyridin-4-yl)prop-2-en-1-ylidene]-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C(\C=C\c2ccncc2)/O)/C1=O)O

STK590431
Synonyms: N-(3,5-dimethylphenyl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK590432
Synonyms: N-{4-[(2-methoxy-5-methylphenyl)carbamoyl]phenyl}-4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-carboxamide
Smiles: COc1ccc(cc1)C1(CCOCC1)C(=O)Nc1ccc(cc1)C(=O)Nc1cc(C)ccc1OC

STK590433
Synonyms: N-(3-chloro-2-methylphenyl)-4,7,7-trimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1cccc(c1C)Cl

STK590434
Synonyms: 3-(4-methylphenyl)-2-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)C(C)C

STK590435
Synonyms: methyl{9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl}acetate
Smiles: COC(=O)Cn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)CCc1ccc(c(c1)OC)OC

STK590437
Synonyms: 9-(5-methyl-1,2-oxazol-3-yl)-10-(3,4,5-trimethoxyphenyl)-9,10-dihydrobenzo[5,6]chromeno[2,3-c]pyrrole-8,11-dione
Smiles: COc1c(OC)cc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc2c1cccc2

STK590438
Synonyms: 6-cyclohexyl-2-hydroxy-1-(2-methylphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(O)n(c2c1CN(CN2)C1CCCCC1)c1ccccc1C

STK590439
Synonyms: 7-chloro-3-ethyl-1',3'-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=O)N(C)C(=O)N(C1=O)C

STK590443
Synonyms: (3a'S,6a'R)-5'-(2-methoxyethyl)-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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cccc2

STK590444
Synonyms: N-(3-methoxyphenyl)-1-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1c(c2ccc(cc2)C)c2c3n1cc(n3CCCC2)c1ccccc1

STK590446
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-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)N1c1nnc(s1)SCc1ccccc1

STK590447
Synonyms: (E)-[3-fluoro-4-(propan-2-yloxy)phenyl]{2-(4-methylphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC(Oc1ccc(cc1F)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)CC[NH+]1CCOCC1)/[O-])C

STK590448
Synonyms: (E)-[2-(3-butoxyphenyl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-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)N1Cc1cc[nH+]cc1

STK590449
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-3'-(4-hydroxybenzyl)-6,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1ccc(c2C)C)C

STK590451
Synonyms: N'-[(E)-(2-chloro-6-methylquinolin-3-yl)methylidene]-4-methylbenzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/c1cc2cc(C)ccc2nc1Cl

STK590452
Synonyms: (4E)-2-(1,3-benzodioxol-5-yl)-4-(ethoxymethylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCO/C=C\1/C(=O)N(c2ccc3c(c2)OCO3)C(=O)c2c1cccc2

STK590453
Synonyms: N-[(2-fluorobenzyl)carbamoyl]-L-alanine
Smiles: O=C(N[C@H](C(=O)O)C)NCc1ccccc1F

STK590455
Synonyms: 2',6'-dihydroxy-7,9,9-trimethyl-3-nitro-6a,7,8,9,10,11-hexahydro-4'H,5H-spiro[7,11-methanoazepino[1,2-a]quinoline-6,5'-pyrimidin]-4'-one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2C2(C)CC1CC(C2)(C)C)[N+](=O)[O-]

STK590456
Synonyms: 2-{[3-cyano-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: COc1ccc(cc1)C1C(=C(SCC(=O)Nc2c(C)cccc2CC)N=C2C1=C(O)CC(C2)(C)C)C#N

STK590460
Synonyms: 8-{[benzyl(methyl)ammonio]methyl}-3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: COc1cc(ccc1OC)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+](Cc1ccccc1)C)[O-]

STK590462
Synonyms: 2-amino-5-hydroxy-4-(3,4,5-trimethoxyphenyl)-4H-pyrano[3,2-c]quinoline-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)c(c(c1)OC)OC)c(O)nc1c2cccc1

STK590463
Synonyms: (3a'S,6a'R)-5'-(4-fluorophenyl)-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

STK590464
Synonyms: (2'S,3S,3'S,10b'R)-2'-(furan-2-ylcarbonyl)-3'-[(2-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK590465
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OC)C1N(c2nccs2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK590467
Synonyms: 2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK590469
Synonyms: ethyl[2-(2-methoxyethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]carbamate
Smiles: COCCN1CCn2c(C1)nc1c2ccc(c1)NC(=O)OCC

STK590471
Synonyms: 3-(2-bromophenoxy)-4-oxo-8-(piperidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCC1)occ(c2=O)Oc1ccccc1Br

STK590473
Synonyms: N'-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-phenylpropyl]-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNCCC(c1ccccc1)C1CCOC(C1)(C)C)C

STK590475
Synonyms: 6-(4-ethenylbenzyl)-9-methoxy-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2Cc1ccc(cc1)C=C

STK590476
Synonyms: 12-(3,4-dimethoxyphenyl)-2-(2-methylphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: COc1ccc(cc1OC)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)c1ccccc1C)O

STK590479
Synonyms: 2-(2-methoxyphenyl)-N-[(2E)-3-(3-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1cccc(c1)N1/C(=N\C(=O)Cc2ccccc2OC)/SC2C1CS(=O)(=O)C2

STK590480
Synonyms: methyl2-[(3E)-3-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nc(c(s1)C(=O)OC)C)/O

STK590481
Synonyms: 8-(4-ethoxyphenyl)-1,3-dimethyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C

STK590482
Synonyms: N-(2,4-dimethoxyphenyl)-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: COc1cc(OC)ccc1NC(=O)CCCCCn1cnc2c(c1=O)cccc2

STK590486
Synonyms: 2-chloro-3-hydroxy-4-{[(pyridin-4-ylmethyl)amino]methyl}-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: Clc1cc2c(c(c1O)CNCc1ccncc1)oc(=O)c1c2CCCC1

STK590487
Synonyms: N-(3-methoxyphenyl)-1-(4-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)OC)n2c3c1CCCCn3c(c2)c1ccccc1

STK590488
Synonyms: 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide
Smiles: CCN(C(=O)CSC(=C(C#N)C#N)Nc1cccc(c1)F)CC

STK590490
Synonyms: (4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK590491
Synonyms: 3-(4-chlorophenyl)-N-(furan-2-ylmethyl)-4-phenylbutan-1-amine
Smiles: Clc1ccc(cc1)C(Cc1ccccc1)CCNCc1ccco1

STK590493
Synonyms: (2Z)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK590495
Synonyms: 6-(3,4-dimethoxyphenyl)-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1OC)C1CC(=C2C(=Nc3n(C2c2cccnc2)ncn3)C1)O

STK590496
Synonyms: 6-hydroxy-8-[(3-hydroxypropyl)sulfanyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COCCn1c(SCCCO)nc2c1c(O)nc(=O)n2C

STK590497
Synonyms: 9-(4-chlorophenyl)-6-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Clc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1C

STK590499
Synonyms: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-N-hexylethanethioamide
Smiles: CCCCCCNC(=S)/C=C/1\NCCc2c1cc(OC)c(c2)OC

STK590504
Synonyms: 2,3-dihydro-1H-indol-1-yl(6-methoxy-1H-indol-2-yl)methanone
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N1CCc2c1cccc2

STK590507
Synonyms: 6-chloro-4-ethyl-2-oxo-2H-chromen-7-ylN-[(benzyloxy)carbonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)CC)NC(=O)OCc1ccccc1

STK590508
Synonyms: N-(3-acetyl-1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide
Smiles: CC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)C(=O)C)C(=O)N(C)C(=O)N(C1=O)C

STK590509
Synonyms: 10-(4-hydroxyphenyl)-1,3-dimethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Oc1ccc(cc1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1cccc(c1)[N+](=O)[O-])C

STK590510
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(2-fluorophenyl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccccc1F

STK590511
Synonyms: (2E)-N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-[3-methoxy-4-(pentyloxy)phenyl]prop-2-enamide
Smiles: CCCCCOc1ccc(cc1OC)/C=C/C(=O)/N=c/1\[nH]nc(s1)CC

STK590514
Synonyms: 3-cyclopentyl-N-[(2Z)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: COc1cccc(c1)CN1/C(=N/C(=O)CCC2CCCC2)/SC2C1CS(=O)(=O)C2

STK590516
Synonyms: 5-bromo-1-{[5-(furan-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]methyl}-1H-indole-2,3-dione
Smiles: Brc1ccc2c(c1)C(=O)C(=O)N2CN1N=C(CC1c1ccco1)c1cccs1

STK590517
Synonyms: 5-{(E)-[2-(2,4,6-trichlorophenyl)hydrazinylidene]methyl}quinoxaline
Smiles: Clc1cc(Cl)c(c(c1)Cl)N/N=C/c1cccc2c1nccn2

STK590518
Synonyms: 3-amino-6-(3-methoxyphenyl)-N-[(2E)-5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]thieno[2,3-b]pyridine-2-carboxamide
Smiles: C=CCSc1n[nH]/c(=N\C(=O)c2sc3c(c2N)ccc(n3)c2cccc(c2)OC)/s1

STK590519
Synonyms: 1-[2-(3,4-dimethoxyphenyl)-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK590520
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-2-[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanamide
Smiles: O=C(C(Oc1ccc2c(c1C)oc(=O)c1c2cccc1)C)NCCCn1cncc1

STK590521
Synonyms: (5E)-5-{1-[(2,5-dimethoxyphenyl)amino]propylidene}-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(\Nc2cc(OC)ccc2OC)/CC)/C1=O)O

STK590522
Synonyms: 4-{(2E)-2-[(5-methoxy-1H-indol-3-yl)methylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: COc1ccc2c(c1)c(/C=N/Nc1ncnc3c1c1CCCCc1s3)c[nH]2

STK590524
Synonyms: 6-hydroxy-1'-methyl-3-(3-methylphenyl)-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: Cc1cccc(c1)N1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-])O

STK590525
Synonyms: 3-(4-fluorophenyl)-2-(2-methylphenyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Fc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(s2)cccc1)c1ccccc1C

STK590527
Synonyms: (5E)-5-{1-[(3-fluorophenyl)amino]propylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/Nc1cccc(c1)F

STK590528
Synonyms: N-butyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]methanesulfonamide
Smiles: CCCCN(S(=O)(=O)C)Cc1cc2cccc(c2[nH]c1=O)C

STK590530
Synonyms: N-[2-(dimethylamino)ethyl]-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CN(CCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)C

STK590532
Synonyms: 8-[(3-nitrophenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: [O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK590533
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1ccccc1)c1ccc(cc1)C(C)C

STK590534
Synonyms: ethyl1'-benzyl-4'-hydroxy-8-nitro-2',6'-dioxo-1,1',2,4,4a,6'-hexahydro-2'H,3H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C1=O)Cc1ccccc1)O

STK590535
Synonyms: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-6-hydroxy-3-methyl-8-(3-methylpiperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CC1CCCN(C1)c1nc2c(n1CCSc1nc3c(s1)cccc3)c(O)nc(=O)n2C

STK590537
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-(2-methylphenyl)-4,6,7,8-tetrahydroquinazolin-5-ol
Smiles: OC1=C2C(=NC(=NC2c2ccccc2C)Nc2nc3c(o2)cccc3)CC(C1)(C)C

STK590538
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(benzyloxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1N)c1n[nH]c(c1)C

STK590539
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-6-hydroxy-3-(4-methoxybenzyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)O

STK590540
Synonyms: 1-{N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-beta-alanyl}piperidine-4-carboxylicacid
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)NCCC(=O)N1CCC(CC1)C(=O)O

STK590542
Synonyms: (4Z)-4-[(6-chloro-4-oxo-4H-chromen-3-yl)methylidene]-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc2c(c1)c(=O)c(co2)/C=C\1/C(=NN(C1=O)c1ccccc1)O

STK590543
Synonyms: 7-(2,4-dichlorobenzyl)-1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C

STK590544
Synonyms: N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methoxyphenyl)benzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)c1ccccc1OC

STK590547
Synonyms: (4E)-5-(3-chlorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1nnc(s1)C)/O

STK590548
Synonyms: 2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2ccc(cc2)C)c2c(n1)CC(OC2)(C)C

STK590549
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)N(C)C

STK590552
Synonyms: 4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(C)C

STK590553
Synonyms: methyl4-[5,7-dichloro-2-(5-methyl-1,2-oxazol-3-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK590555
Synonyms: 4-({(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}amino)-5-(2-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK590557
Synonyms: 2-methoxy-N-[2-(2-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Smiles: COc1ccccc1C(=O)Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK590558
Synonyms: 3-benzyl-4-methyl-9-(pyridin-2-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: O=c1oc2c3CN(COc3ccc2c(c1Cc1ccccc1)C)Cc1ccccn1

STK590560
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl)C

STK590562
Synonyms: 5-(2,3-dimethoxyphenyl)-4-hydroxy-2-(methylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1cccc(c1OC)OC

STK590563
Synonyms: 2-(2-chlorophenyl)-N-[(2E)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1F)CS(=O)(=O)C2)Cc1ccccc1Cl

STK590564
Synonyms: (3a'S,6a'R)-3'-benzyl-5-fluoro-5'-(3-methoxypropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cc(F)cc2

STK590565
Synonyms: 4-[(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-5-methyl-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(C)cc2

STK590566
Synonyms: (4E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2-fluorophenyl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1ccccc1Cl)c1ccccc1F

STK590567
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-bromo-2-fluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1F)Br

STK590568
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-[(2-ethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK590571
Synonyms: 2-(2-fluorophenyl)-3-(3-methoxypropyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1F

STK590573
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK590574
Synonyms: N-[4-(3-methoxyphenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]-4-nitrobenzamide
Smiles: COc1cccc(c1)c1c(=O)c(C)nn(c1NC(=O)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)C

STK590575
Synonyms: 3-(4-chlorobenzyl)-9-(3,4-dimethylphenyl)-7-hydroxy-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)Cn1c(=O)c2n3CC(O)CN(c3nc2n(c1=O)C)c1ccc(c(c1)C)C

STK590576
Synonyms: 7-(2-chlorobenzyl)-8-(4-ethylpiperazin-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK590577
Synonyms: 6-(4-chlorophenyl)-9-(3-ethoxy-4-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccc(cc1)Cl

STK590578
Synonyms: N-[(2Z)-3-(2,3-dichlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CC(CC(=O)/N=C/1\SC2C(N1c1cccc(c1Cl)Cl)CS(=O)(=O)C2)C

STK590579
Synonyms: 4-chloro-N-ethyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2[nH]c1=O

STK590580
Synonyms: N-(4-{(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}phenyl)acetamide
Smiles: COc1cc(ccc1O)C1N(c2ccc(cc2)NC(=O)C)C(=O)C(=O)/C/1=C(\c1ccccc1)/O

STK590581
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2-chlorophenyl)-7-ethyl-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: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl

STK590582
Synonyms: N-(4-bromo-2-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Br)nnc1c1cccc(c1)C

STK590583
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK590584
Synonyms: 5-(3-ethoxyphenyl)-4-{[(E)-(4-ethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OCC

STK590587
Synonyms: 2-{2-[(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]ethoxy}ethanol
Smiles: OCCOCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK590588
Synonyms: 8-{[bis(2-methylpropyl)ammonio]methyl}-3-(2-bromophenoxy)-2-methyl-4-oxo-4H-chromen-7-olate
Smiles: CC(C[NH+](Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1ccccc1Br)CC(C)C)C

STK590590
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-[4-(dimethylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CN(c1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OCc1ccccc1)C

STK590592
Synonyms: (5Z)-5-[2-(4-acetylpiperazin-1-yl)-5-nitrobenzylidene]-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C\c2cc(ccc2N2CCN(CC2)C(=O)C)[N+](=O)[O-])/C(=N1)O

STK590593
Synonyms: N-benzyl-2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: O=C(NCc1ccccc1)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK590597
Synonyms: 2-(6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide
Smiles: NC(=O)Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2

STK590598
Synonyms: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CN1CCN(CC1)C/C=C/c1ccccc1

STK590599
Synonyms: 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(4-sulfamoylbenzyl)propanamide
Smiles: O=C(NCc1ccc(cc1)S(=O)(=O)N)CCc1c(=O)oc2c(c1C)ccc(c2C)O

STK590600
Synonyms: 3,4-dimethoxy-N-(2-methoxyethyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COCCN(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2cccc(c2[nH]c1=O)C

STK590601
Synonyms: N'-{(1E)-1-[4-hydroxy-1-(2-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}heptanehydrazide
Smiles: CCCCCCC(=O)NN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC

STK590603
Synonyms: 1-(4-methoxyphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)OC)nnc1COc1ccc(cc1)C

STK590605
Synonyms: 4-{[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cl/C(=C\c1ccccc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK590606
Synonyms: N-(3-hydroxypropyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2

STK590607
Synonyms: (2'S,3S,3'S,10b'R)-3'-(naphthalen-1-ylcarbonyl)-2'-(pyridin-4-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)cccc3)c1cccc2c1cccc2

STK590610
Synonyms: 3-(2-fluorophenyl)-1',3'-bis(2-methylpropyl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC(CN1C(=O)N(CC(C)C)C(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)c1ccccc1F)C

STK590611
Synonyms: (2'S,3S,3'S,10b'R)-2',3'-bis[(4-fluorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)cccc3

STK590613
Synonyms: 1-(4-chlorophenyl)-3-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)N1C(=O)CC(C1=O)N1C(=S)S/C(=C\c2c[nH]c3c2cccc3)/C1=O

STK590615
Synonyms: 2-(furan-2-yl)-3-[2-(4-methoxyphenyl)ethyl]-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc(cc1)CCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccco1

STK590618
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK590619
Synonyms: 7-fluoro-1-(3-fluorophenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1cccc(c1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK590620
Synonyms: 3,6-diamino-5-cyano-N-(2,2-diphenylethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)NCC(c1ccccc1)c1ccccc1

STK590621
Synonyms: (4E)-4-[({4-[(difluoromethyl)sulfanyl]phenyl}amino)methylidene]-2-(6-methylpyridin-2-yl)isoquinoline-1,3(2H,4H)-dione
Smiles: FC(Sc1ccc(cc1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(n1)C)F

STK590623
Synonyms: 2,2-dimethyl-5-(2-methylpropyl)-8-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCOCC1)C

STK590625
Synonyms: 7-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}[1,3]dioxolo[4,5-g]quinolin-6-ol
Smiles: Oc1nc2cc3OCOc3cc2cc1/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK590626
Synonyms: 1-(3,4-dichlorophenyl)-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: O=C(c1ccc(c(c1)Cl)Cl)CSc1nnc(n1c1ccccc1)c1ccccc1

STK590627
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: COc1cc(CCNc2nc(nc3c2oc2c3cccc2)c2ccccc2)ccc1OC

STK590628
Synonyms: (4E)-2-phenyl-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccccc2)C(=O)c2c(/C/1=C\NCc1ccccn1)cccc2

STK590630
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)F)N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/O

STK590631
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(3-methoxy-4-propoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1ccc(cc1OC)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK590633
Synonyms: 4-{[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cccc(c1O)OC

STK590634
Synonyms: 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: Cc1cccc(c1)c1nc(SCC(=O)N(c2ccccc2)c2ccccc2)c2c(n1)CC(OC2)(C)C

STK590635
Synonyms: 7-bromo-2-(2-hydroxyethyl)-1-(3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)OC)c(=O)c1c(o2)ccc(c1)Br

STK590638
Synonyms: 4-(3-chlorophenyl)-1-[(4-fluorobenzyl)sulfanyl]-8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccc(cc1)F)nn2)c1cccc(c1)Cl

STK590639
Synonyms: 3-(3,5-dimethoxybenzyl)-6-hydroxy-1'-methyl-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: COc1cc(cc(c1)OC)CN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-])O

STK590640
Synonyms: 3-[(4-tert-butylbenzyl)sulfanyl]-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1C)SCc1ccc(cc1)C(C)(C)C

STK590641
Synonyms: (3'E)-1-butyl-3'-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1'-(2-methoxyethyl)spiro[indole-3,2'-pyrrolidine]-2,4',5'(1H)-trione
Smiles: CCCCN1c2ccccc2C2(C1=O)/C(=C(/c1ccc3c(c1)OCCO3)\O)/C(=O)C(=O)N2CCOC

STK590642
Synonyms: (5E)-5-[1-(azepan-1-ylamino)ethylidene]-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C(\NN2CCCCCC2)/C)/C1=O)O

STK590643
Synonyms: ethyl4-[3-(2-fluorobenzyl)-1-methyl-2,4-dioxo-1,2,3,4,6,7-hexahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STK590645
Synonyms: (2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1-(3-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}phenyl)ethanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cccc(c1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2

STK590647
Synonyms: 2-[(6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCc1ccccn1)C

STK590648
Synonyms: N-(biphenyl-2-yl)-2-{[4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1c1ccccc1)CSc1nnc(n1C)c1cccc(c1)C

STK590649
Synonyms: 3-{[5-chloro-6-oxo-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,6-dihydropyridazin-4-yl]amino}-4-methoxybenzoicacid
Smiles: COc1ccc(cc1Nc1cnn(c(=O)c1Cl)C12CC3CC(C2)CC(C1)C3)C(=O)O