Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

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STK586199
Synonyms: 1',3'- dimethyl- 14,15- dihydro- 2'H,4bH,6H- spiro[benzo[g]isoquino[2,1- a][1,8]naphthyridine- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc3ccccc3nc1N1C2c2ccccc2CC1

STK586200
Synonyms: 3- [(4- tert- butylbenzyl)sulfanyl]- 4- ethyl- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: CCn1c(nnc1COc1ccc(cc1)C)SCc1ccc(cc1)C(C)(C)C

STK586201
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1ccccc1Cl

STK586204
Synonyms: 4- (propan- 2- yl)- N- [3- (propan- 2- yloxy)propyl]- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CC(OCCCNc1ncnc2c1sc1c2c2CCCc2c(n1)C(C)C)C

STK586205
Synonyms: 1'- (2,4- dimethylphenyl)- 4- methyl- 3,4- dihydro- 1H,2'H- spiro[benzo[f]quinoline- 2,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)C2(C1=O)CN(C)c1c(C2)c2ccccc2cc1

STK586207
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methoxyphenyl)carbonyl]- 2'- {[4- (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=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586208
Synonyms: 2- (ethylsulfanyl)- 9- (3- nitrophenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cccc(c1)[N+](=O)[O-]

STK586210
Synonyms: 2- (10- methoxy- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCCSc1n2)OC

STK586212
Synonyms: 2- methyl- N- [(Z)- (3- oxo- 1- benzothiophen- 2(3H)- ylidene)methyl]- N- phenylpropanamide
Smiles: O=C(N(c1ccccc1)/C=C/1\Sc2c(C1=O)cccc2)C(C)C

STK586218
Synonyms: 3- (4- fluorophenyl)- 2- oxo- 2H- chromen- 7- yltrans- 4- {[(tert- butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1ccc(cc1)F

STK586219
Synonyms: 2- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK586223
Synonyms: N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}- 2,2- diphenylacetamide
Smiles: O=C(C(c1ccccc1)c1ccccc1)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK586224
Synonyms: 5- ethoxy- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1cc(OC)c(c(c1)OC)OC

STK586225
Synonyms: 7- chloro- 2- (pyridin- 2- yl)- 1- (pyridin- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccnc1)c1ccccn1

STK586226
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK586228
Synonyms: 2- [(2,6- dimethylphenoxy)methyl]- 10- methyl- 8- phenyl- 11- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)COc1c(C)cccc1C)c1ccccc1

STK586230
Synonyms: 6- hydroxy- 1'- methyl- 6'- nitro- 2'- phenyl- 3- (prop- 2- en- 1- yl)- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: C=CCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-])O

STK586231
Synonyms: 1- {[7- (4- chlorobenzyl)- 1,3- dimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]methyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK586233
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (10- fluoro- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)acetamide
Smiles: COc1ccc(cc1OC)CCNC(=O)Cn1c2ccc(cc2c2c1c(=O)n1c(n2)SCCC1)F

STK586234
Synonyms: (1'R,2'R)- 1'- [(4- chlorophenyl)carbonyl]- 2'- (4- fluorophenyl)- 7'- methyl- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Fc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C

STK586235
Synonyms: 9- (2- fluorophenyl)- 6- (2- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Oc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2F)ncn3)C1)O

STK586236
Synonyms: 3- hydroxy- 4- {[(pyridin- 4- ylmethyl)amino]methyl}- 6H- benzo[c]chromen- 6- one
Smiles: Oc1ccc2c(c1CNCc1ccncc1)oc(=O)c1c2cccc1

STK586237
Synonyms: (1'S,3R,3'S,7a'S)- 5''- fluoro- 1'- [(3- nitrophenyl)carbonyl]- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Fc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK586238
Synonyms: 8- [(4- ethylpiperazin- 1- ium- 1- yl)methyl]- 3- (naphthalen- 2- yloxy)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK586239
Synonyms: (4E)- 4- [hydroxy(4- methylphenyl)methylidene]- 5- (4- methoxyphenyl)- 1- methylpyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1C

STK586241
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK586244
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 6,7- dihydro- 5H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- ol
Smiles: Clc1ccccc1CSc1nc2n(n1)c(O)c1c(n2)CCC1

STK586247
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)(3- methylthiophen- 2- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1sccc1C

STK586248
Synonyms: 1- (3,4- dimethoxyphenyl)- 2- (4- methylbenzyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1OC)C1N(Cc2ccc(cc2)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK586253
Synonyms: N- [4- (4- chlorophenyl)- 2- (3,4- dimethylphenyl)- 6- methyl- 5- oxo- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: Clc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1)c1ccc(c(c1)C)C

STK586255
Synonyms: (2E)- 3- [2- (azepan- 1- yl)- 9- methyl- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 3- yl]- 2- (phenylsulfonyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCCCCC1)/S(=O)(=O)c1ccccc1

STK586257
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- fluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1COc1ccc(cc1)Cl

STK586263
Synonyms: (E)- (4- butoxyphenyl)[2- (4- hydroxyphenyl)- 4,5- dioxo- 1- (pyridinium- 3- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc[nH+]c1)/[O-]

STK586264
Synonyms: (1'S,3R,3'S,7a'S)- 5''- methyl- 1'- [(3- nitrophenyl)carbonyl]- 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)c1cccc(c1)[N+](=O)[O-]

STK586267
Synonyms: (5Z)- 6- hydroxy- 5- [(2E)- 1- hydroxy- 3- (1H- indol- 3- yl)prop- 2- en- 1- ylidene]- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\C=C\c2c[nH]c3c2cccc3)/O)/C1=O)O

STK586268
Synonyms: (5Z)- 6- hydroxy- 5- [(2E)- 1- hydroxy- 3- (4- hydroxy- 3- methoxyphenyl)prop- 2- en- 1- ylidene]- 3- (3- methoxypropyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccc(c(c2)OC)O)/O)/C1=O)O

STK586270
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)N=C(CC1c1ccco1)O

STK586272
Synonyms: 8- (heptylsulfanyl)- 6- hydroxy- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCCSc1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK586274
Synonyms: N'- [(E)- (2,3- dimethoxyphenyl)methylidene]- 4- methoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2cc3c([nH]2)cccc3OC)cccc1OC

STK586275
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (2,5- dimethoxyphenyl)- 6- [2- (dimethylamino)ethyl]- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: COc1ccc(cc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CCN(C)C)OC

STK586276
Synonyms: 2- [7- (3,4- dichlorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]- 5- methoxyphenol
Smiles: COc1ccc(c(c1)O)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)Cl)Cl

STK586279
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[methyl(phenyl)amino]methyl}- N'- [(1E)- 1- phenylpropylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC/C(=N\NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)/c1ccccc1

STK586280
Synonyms: 2- [(5Z)- 5- (2- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (4- hydroxyphenyl)ethyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2F)/C1=O)NCCc1ccc(cc1)O

STK586282
Synonyms: 3- {2- [4- (3- chlorophenyl)piperazin- 1- yl]- 2- oxoethyl}quinazolin- 4(3H)- one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)Cn1cnc2c(c1=O)cccc2

STK586284
Synonyms: 2- tert- butyl4- ethyl5- [(4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)amino]- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(NC2OC(=O)c3c2ccc(c3OC)OC)sc(c1C)C(=O)OC(C)(C)C

STK586285
Synonyms: N- (4- methylphenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK586286
Synonyms: (3a'S,6a'R)- 5- bromo- 3'- (1- hydroxyethyl)- 5'- (2- phenylethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Brc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)CCc1ccccc1)C(O)C)C(=O)N2

STK586287
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 10- fluoro- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: Fc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1c(F)cccc1Cl

STK586289
Synonyms: (3R,3'S,5'S)- N- (4- fluorophenyl)- 5- methyl- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: CC(C[C@H]1C[C@@H]([C@]2(N1)C(=O)Nc1c2cc(C)cc1)C(=O)Nc1ccc(cc1)F)C

STK586290
Synonyms: (5Z)- 5- [5- (3,4- dimethoxyphenyl)pyrazolidin- 3- ylidene]- 6- hydroxy- 3- (3- methoxypropyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COCCCN1C(=O)N=C(/C(=C\2/NNC(C2)c2ccc(c(c2)OC)OC)/C1=O)O

STK586291
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK586293
Synonyms: 1- (4- chlorophenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1COc1ccccc1

STK586294
Synonyms: 6- (4- fluorophenyl)- 2- [(4- methylquinazolin- 2- yl)amino]pyrimidin- 4- ol
Smiles: Oc1nc(Nc2nc(C)c3c(n2)cccc3)nc(c1)c1ccc(cc1)F

STK586295
Synonyms: 3- butyl- 8- (3- methoxyphenyl)- 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)OC

STK586297
Synonyms: (5E)- 3- butyl- 5- {1- [(4- fluorobenzyl)amino]ethylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCN1C(=O)N=C(/C(=C(\NCc2ccc(cc2)F)/C)/C1=O)O

STK586298
Synonyms: N- (3- ethoxypropyl)- 2- (ethylsulfanyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCOCCCNc1nc(SCC)nc2c1c1CC(C)(C)OCc1s2

STK586299
Synonyms: 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc(cc1)C

STK586300
Synonyms: N- (3,4- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK586302
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK586303
Synonyms: N- (3- hydroxypropyl)- 5,10- dimethyl- 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(nc2C)sc2c1CC(C)CC2

STK586304
Synonyms: N'- [(E)- quinoxalin- 6- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc2c(c1)nccn2

STK586306
Synonyms: 9- (3- chlorophenyl)- 3- (2- methoxyethyl)- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)Cl

STK586308
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- fluorophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)F)nnc1COc1ccc(cc1)Cl

STK586309
Synonyms: (4E)- 1- butyl- 4- [hydroxy(phenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CCCCN1C(c2ccccc2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK586310
Synonyms: (4E)- 4- [(1- {3- [benzyl(methyl)amino]- 2- hydroxypropyl}- 1H- indol- 3- yl)methylidene]- 5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CN(CC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)O)Cc1ccccc1

STK586311
Synonyms: N- [(1Z)- 3- (azepan- 1- yl)- 1- (2- hydroxy- 7- methoxyquinolin- 3- yl)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: COc1ccc2c(c1)nc(c(c2)/C=C(/C(=O)N1CCCCCC1)\NC(=O)c1ccccc1)O

STK586312
Synonyms: N- (2- ethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK586314
Synonyms: 3- (2- ethoxyphenyl)- 1',3'- dimethyl- 8- nitro- 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: CCOc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N(C)C(=O)N(C1=O)C

STK586316
Synonyms: 1- amino- 4- [(4- fluorophenyl)amino]- 2- (morpholin- 4- yl)anthracene- 9,10- dione
Smiles: Fc1ccc(cc1)Nc1cc(N2CCOCC2)c(c2c1C(=O)c1ccccc1C2=O)N

STK586317
Synonyms: N- [(2Z)- 5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)/N=c\1/[nH]nc(s1)SCc1ccccc1

STK586318
Synonyms: (3a'S,6a'R)- 5- chloro- 5'- (2- chlorobenzyl)- 3'- (1- hydroxyethyl)- 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: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(Cl)cc1C)O

STK586322
Synonyms: 7- fluoro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (pyridin- 4- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)c1noc(c1)C

STK586323
Synonyms: 5- ({2- [(2- fluorobenzyl)oxy]- 3- methoxybenzyl}amino)- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: COc1cccc(c1OCc1ccccc1F)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK586324
Synonyms: 4- {[(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]amino}- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1cc(/C=N/n2c(=S)[nH]nc2c2cccnc2)c(c(c1)Br)O

STK586326
Synonyms: N- (2- bromophenyl)- 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK586328
Synonyms: N- (3,4- dichlorophenyl)- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CCCn1cnc2c(c1=O)cccc2

STK586329
Synonyms: 2- (5- hydroxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (pyridin- 2- ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)NCc1ccccn1

STK586331
Synonyms: 2- methyl- N- (4- methylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]propanamide
Smiles: Cc1ccc(cc1)N(C(=O)C(C)C)Cc1cc(=O)[nH]c2c1cccc2

STK586332
Synonyms: 5- (4- chlorophenyl)- 3- (2- hydroxyphenyl)- 1- (1H- indol- 3- ylmethyl)- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c[nH]c2c1cccc2)C(=O)O

STK586333
Synonyms: (5E)- 5- {1- [(4- fluorophenyl)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)/Nc1ccc(cc1)F

STK586335
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- {[5- (3- chlorophenyl)- 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)nnc1c1cccc(c1)Cl

STK586337
Synonyms: 3- [(naphthalen- 1- ylmethyl)sulfanyl]- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 4- amine
Smiles: Nn1c(SCc2cccc3c2cccc3)nnc1c1n[nH]c(c1)c1ccccc1

STK586338
Synonyms: 5- (3- methylphenyl)- 4- {[(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/C=C/c1ccccc1

STK586339
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cccc(c1C)Cl

STK586340
Synonyms: 4- methoxy- N- (2- methylpropyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccccc2[nH]c1=O)CC(C)C

STK586342
Synonyms: 1- (4- ethoxyphenyl)- 3- {4- hydroxy- 6- [(pyridin- 2- ylsulfanyl)methyl]pyrimidin- 2- yl}guanidine
Smiles: CCOc1ccc(cc1)NC(=N)Nc1nc(O)cc(n1)CSc1ccccn1

STK586343
Synonyms: 2- {4- [6- hydroxy- 3- methyl- 2- oxo- 7- (3- phenylpropyl)- 3,7- dihydro- 2H- purin- 8- yl]piperazin- 1- yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STK586346
Synonyms: (3Z)- 1- (4- chloro- 3- methylphenoxy)- 3- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)propan- 2- one
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)COc1ccc(c(c1)C)Cl

STK586349
Synonyms: 8- benzyl- N- (3- methoxypropyl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: COCCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK586350
Synonyms: 4- nitro- N- [2- (2- phenylethyl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazol- 8- yl]benzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK586351
Synonyms: 8- [bis(2- hydroxyethyl)amino]- 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCN(c1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C)CCO

STK586352
Synonyms: (4E)- 5- (3- butoxyphenyl)- 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: CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK586353
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1c1cccc(c1)C

STK586354
Synonyms: 1- (4- chlorophenyl)- 6- (furan- 2- ylmethyl)- 2- hydroxy- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)Cc1ccco1

STK586356
Synonyms: N- [2- (2- hydroxyethoxy)ethyl]- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCOCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK586358
Synonyms: N,4- bis(4- chlorophenyl)- 1- (4- ethylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK586359
Synonyms: N'- [(E)- (4- ethoxyphenyl)methylidene]- 5- methoxy- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2)OC

STK586362
Synonyms: N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- [(4- oxo- 3- phenyl- 3,4- dihydroquinazolin- 2- yl)sulfanyl]acetamide
Smiles: CCc1n[nH]/c(=N\C(=O)CSc2nc3ccccc3c(=O)n2c2ccccc2)/s1

STK586363
Synonyms: 8- [(4- benzylpiperazin- 1- yl)methyl]- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK586364
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccccc2)c2cnccn2)cc(c1)OC

STK586365
Synonyms: 2- [(2Z)- 4- hydroxy- 2- (phenylimino)- 2,5- dihydro- 1,3- thiazol- 5- yl]- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CC1S/C(=N\c2ccccc2)/N=C1O

STK586367
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- [4- (benzyloxy)phenyl]- 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: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)OCc1ccccc1

STK586368
Synonyms: 3'- (4- bromophenyl)- 6'- hydroxy- 2,4- dimethyl- 8- nitro- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1)Br)O)[N+](=O)[O-]

STK586370
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1COc1ccccc1

STK586371
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)OC)OC

STK586372
Synonyms: tert- butyl(3S)- 3- ({(2R)- 1- [(3- methylphenyl)amino]- 1- oxopropan- 2- yl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: Cc1cccc(c1)NC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK586373
Synonyms: N- [(2Z)- 3- (2,3- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=C/1\SC2C(N1c1cccc(c1C)C)CS(=O)(=O)C2

STK586374
Synonyms: N- cyclohexyl- 5- methoxy- N,3- dimethyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N(C1CCCCC1)C

STK586375
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (1,3- benzodioxol- 5- ylcarbonyl)- 2'- [(4- methylphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Cc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586376
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK586377
Synonyms: (3a'S,6a'R)- 5'- tert- butyl- 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)C(C)(C)C)C(=O)Nc1c2cccc1

STK586379
Synonyms: (E)- {2- (4- bromophenyl)- 1- [2- (diethylammonio)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(4- chlorophenyl)methanolate
Smiles: CC[NH+](CCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C1=O)CC

STK586381
Synonyms: N- [3- (4- methoxyphenyl)- 3- phenylpropyl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1)C(c1ccccc1)CCNC(=O)C1CCCCC1

STK586383
Synonyms: 4- [(2E)- 2- {4- methoxy- 3- [(3- methoxyphenoxy)methyl]benzylidene}hydrazinyl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: COc1ccc(cc1COc1cccc(c1)OC)/C=N/Nc1ncnc2c1c1CCCCc1s2

STK586384
Synonyms: 1- (4- methoxyphenyl)- 6,7- dimethyl- 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)cc(c(c1)C)C

STK586385
Synonyms: (5Z)- 3- phenyl- 5- [(1,3- thiazol- 2- ylamino)methylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\Nc2nccs2)/C(=O)N1c1ccccc1

STK586387
Synonyms: N- {(1Z)- 1- [1- cyano- 2- (morpholin- 4- yl)- 2- oxoethylidene]- 1H- isoindol- 3- yl}furan- 2- carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccco1)/C(=O)N1CCOCC1

STK586389
Synonyms: 4- chloro- N- [(1Z)- 1- {1- cyano- 2- oxo- 2- [(2- phenylethyl)amino]ethylidene}- 1H- isoindol- 3- yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C(=O)NCCc1ccccc1

STK586390
Synonyms: 7- (4- chlorobenzyl)- 8- [(4- ethylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK586391
Synonyms: 6- amino- 1- (4- fluorophenyl)- 4- (4- methoxyphenyl)- 3- methyl- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)OC)c(C)nn2c1ccc(cc1)F

STK586396
Synonyms: N- {(1Z)- 1- [1- cyano- 2- (morpholin- 4- yl)- 2- oxoethylidene]- 1H- isoindol- 3- yl}- 2- fluorobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1F)/C(=O)N1CCOCC1

STK586399
Synonyms: 8- benzyl- N- (2- methylpropyl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: CC(CNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1)C

STK586400
Synonyms: 2- {[4- ethyl- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- phenoxyphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nnc1COc1ccccc1

STK586401
Synonyms: 4- (4- fluorophenyl)- 2- (2- methylphenyl)- 5- phenyl- 1H- imidazole
Smiles: Fc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1ccccc1C

STK586402
Synonyms: 3- chloro- N- [(2Z)- 3- {[2- (4- sulfamoylphenyl)ethyl]amino}quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCCc1ccc(cc1)S(=O)(=O)N

STK586404
Synonyms: N~2~- ({1- [N- (tert- butoxycarbonyl)- D- phenylalanyl]piperidin- 4- yl}carbonyl)- N- (4- fluorophenyl)- D- leucinamide
Smiles: CC(C[C@H](C(=O)Nc1ccc(cc1)F)NC(=O)C1CCN(CC1)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C

STK586405
Synonyms: N- [(2Z)- 3- (3,4- dimethoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: COc1cc(ccc1OC)CN1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK586406
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1ccc(cc1)Cl

STK586407
Synonyms: N- (biphenyl- 2- yl)- 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccccc1c1ccccc1

STK586408
Synonyms: 5- (4- fluorophenyl)- 4- {[(E)- (5- methylthiophen- 2- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(s1)C

STK586409
Synonyms: 4,6- dimethoxy- N'- {(E)- [4- (prop- 2- en- 1- yloxy)phenyl]methylidene}- 1H- indole- 2- carbohydrazide
Smiles: C=CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(cc2OC)OC

STK586410
Synonyms: N- [4- (dimethylamino)phenyl]- 2- {[5- (4- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccc(cc1)OC

STK586412
Synonyms: 3- (5- {(Z)- [1- (2- fluorobenzyl)- 2- hydroxy- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}furan- 2- yl)- 4- methylbenzoicacid
Smiles: OC(=O)c1ccc(c(c1)c1ccc(o1)/C=C/1\N=C(N(C1=O)Cc1ccccc1F)O)C

STK586413
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (naphthalen- 2- yl)ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1c1cccc(c1)Cl

STK586414
Synonyms: (5Z)- 5- {1- [(furan- 2- ylmethyl)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)/NCc1ccco1

STK586415
Synonyms: N- (2,5- dimethylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1Cc1cccs1

STK586417
Synonyms: 4- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 2- propylpyridine
Smiles: CCCc1nccc(c1)c1scc(n1)c1ccc2c(c1)OCO2

STK586419
Synonyms: N- [1- methyl- 3- (3- methylphenyl)- 4- oxo- 1,4- dihydroquinolin- 2- yl]- 2- phenylacetamide
Smiles: O=C(Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C)Cc1ccccc1

STK586420
Synonyms: (2E)- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 2- cyano- 3- (6- hydroxy- 4- oxo- 4H- chromen- 3- yl)prop- 2- enamide
Smiles: N#C/C(=C\c1coc2c(c1=O)cc(cc2)O)/C(=O)/N=c\1/sc2c([nH]1)cccc2

STK586425
Synonyms: 3- (3,4- dimethoxyphenyl)- 5- propylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1cc(O)n2c(n1)c(cn2)c1ccc(c(c1)OC)OC

STK586426
Synonyms: 1'- (2,2- dimethoxyethyl)- 6- hydroxy- 3- (4- methylphenyl)- 6'- nitro- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C2=O)c1ccc(cc1)C)O)OC

STK586427
Synonyms: (5E)- 2- [4- (3- methylphenyl)piperazin- 1- yl]- 5- ({5- [3- (trifluoromethyl)phenyl]furan- 2- yl}methylidene)- 1,3- thiazol- 4(5H)- one
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2cccc(c2)C(F)(F)F)/S1

STK586428
Synonyms: 2- (10- chloroanthracen- 9- yl)- 5- (2,3- dichlorophenyl)- 4- phenyl- 1H- imidazole
Smiles: Clc1c(Cl)cccc1c1[nH]c(nc1c1ccccc1)c1c2ccccc2c(c2c1cccc2)Cl

STK586430
Synonyms: N- (4- butylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccc(cc1)C

STK586431
Synonyms: 6- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]- D- alaninate
Smiles: O=C(N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)C)OCc1ccccc1

STK586432
Synonyms: N,N- diethyl- 2- {[5- (2- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccccc1)c1ccccc1OC)CC

STK586433
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK586434
Synonyms: 8- (4- ethoxyphenyl)- 1,7- dimethyl- 3- [2- (morpholin- 4- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: CCOc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK586435
Synonyms: 4- chloro- N- methyl- N- (3- sulfanylquinoxalin- 2- yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(c1nc2ccccc2nc1S)C

STK586436
Synonyms: (4E)- 4- {[(3,5- dichlorophenyl)amino]methylidene}- 2- phenylisoquinoline- 1,3(2H,4H)- dione
Smiles: Clc1cc(N/C=C/2\c3ccccc3C(=O)N(C2=O)c2ccccc2)cc(c1)Cl

STK586438
Synonyms: (2- chloro- 6- fluorophenyl)(7- methylidene- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)methanone
Smiles: C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1c(F)cccc1Cl

STK586440
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK586441
Synonyms: N- (2- methoxyphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK586443
Synonyms: N- (2- hydroxyethyl)- 5,11- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1C(C)CCC2

STK586444
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK586446
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- difluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1COc1ccc(cc1)Cl

STK586447
Synonyms: N- (3- methylphenyl)- 2- [(2- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK586448
Synonyms: N- (2,5- dimethylphenyl)- 5- (2- hydroxy- 4- methylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(c(c1)O)c1[nH]nc(c1)C(=O)Nc1cc(C)ccc1C

STK586452
Synonyms: 3- tert- butyl- 7- (5- chloro- 2- methylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccc(c(c1)n1ncc2c1ncn1c2nnc1C(C)(C)C)C

STK586453
Synonyms: (2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK586454
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2,5- dichlorophenyl)- 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)c1cc(Cl)ccc1Cl

STK586455
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK586457
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1C)c1cccc(c1)Cl

STK586458
Synonyms: 1- (2- hydroxyethyl)- 2- imino- 10- methyl- 3- (phenylsulfonyl)- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: OCCn1c2nc3c(C)cccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccccc1

STK586459
Synonyms: (5Z)- 1- (2,3- dichlorophenyl)- 5- {[2,5- dimethyl- 1- (quinolin- 6- yl)- 1H- pyrrol- 3- yl]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc2c(c1)cccn2)C)c1cccc(c1Cl)Cl

STK586460
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)C)nnc1COc1ccc(cc1)Cl

STK586461
Synonyms: (5E)- 5- {[(1- benzylpiperidin- 4- yl)amino]methylidene}- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]pyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NC1CCN(CC1)Cc1ccccc1)c1cccc(c1)C(F)(F)F

STK586463
Synonyms: 6- chloro- 2- oxo- 4- propyl- 2H- chromen- 7- ylN- [(benzyloxy)carbonyl]norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)CCC)NC(=O)OCc1ccccc1

STK586464
Synonyms: 3- (1H- benzimidazol- 2- yl)- N- (3- methoxypropyl)propanamide
Smiles: COCCCNC(=O)CCc1nc2c([nH]1)cccc2

STK586465
Synonyms: [4- amino- 3- (2- methoxyethyl)- 2- thioxo- 2,3- dihydro- 1,3- thiazol- 5- yl](pyrrolidin- 1- yl)methanone
Smiles: COCCn1c(=S)sc(c1N)C(=O)N1CCCC1

STK586467
Synonyms: N- [(2S)- 1- [(4- methoxyphenyl)amino]- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 1- [(4- methylphenyl)sulfonyl]piperidine- 4- carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(cc1)OC)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK586469
Synonyms: (E)- {2- (4- bromophenyl)- 1- [4- (dimethylammonio)phenyl]- 4,5- dioxopyrrolidin- 3- ylidene}(4- chlorophenyl)methanolate
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1c1ccc(cc1)[NH+](C)C

STK586470
Synonyms: 3'- (4- chlorophenyl)- 6'- hydroxy- 2,4- dimethyl- 8- nitro- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)[N+](=O)[O-]

STK586473
Synonyms: 6- chloro- 4- ethyl- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: CCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)Cc1ccncc1

STK586474
Synonyms: 2- [(3- benzyl- 4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- cyclopropylacetamide
Smiles: O=C(NC1CC1)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1

STK586477
Synonyms: 8- (3,5- dimethylphenyl)- 1,6,7- trimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cc1cc(C)cc(c1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK586478
Synonyms: (5Z)- 5- {[(2',6'- dihydroxy- 3- methyl- 4'- oxo- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 8- yl)amino]methylidene}- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=NC(=NC2=O)O)O)/C1=O)O

STK586479
Synonyms: 2- [(6- chloro- 2- oxo- 4- propyl- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- ylmethyl)propanamide
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCc1ccccn1)C

STK586481
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(1Z)- 1- (4- chlorophenyl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Clc1ccc(cc1)/C(=N\NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)/C

STK586483
Synonyms: 2- (3,4- dichlorophenyl)- 8,9- dimethoxy- 5,6- dihydropyrrolo[2,1- a]isoquinoline
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c3)c1ccc(c(c1)Cl)Cl

STK586486
Synonyms: 1- (3- chlorophenyl)- 6- (prop- 2- en- 1- yl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: C=CCN1CNc2c(C1)c(=O)nc(n2c1cccc(c1)Cl)S

STK586487
Synonyms: N- (4- bromo- 2- methylphenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2C)Br)nnc1COc1ccc(cc1)Cl

STK586488
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (3- chloro- 4- fluorophenyl)- 3'- (propan- 2- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC([C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(c(c1)Cl)F)C(=O)Nc1c2cccc1)C

STK586489
Synonyms: N- (4- chlorophenyl)- 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}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CC(OC3)(C)C

STK586490
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK586491
Synonyms: methylN- {[2- (trifluoromethyl)phenyl]carbamoyl}- D- phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1C(F)(F)F)Cc1ccccc1

STK586492
Synonyms: 4- (benzyloxy)- N- [(5Z)- 5- (2,5- dimethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: COc1ccc(c(c1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1)OC

STK586494
Synonyms: 8- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (3- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1cccc(c1)Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK586495
Synonyms: 4- ({4- chloro- N- [3- (2,3,5,9- tetramethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]phenylalanyl}amino)butanoicacid
Smiles: O=C(NC(C(=O)NCCCC(=O)O)Cc1ccc(cc1)Cl)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C

STK586496
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- hydroxy- 7,7- dimethyl- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1ccc(cc1)Cl

STK586497
Synonyms: N- [(3- bromophenyl)carbamoyl]- L- phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1cccc(c1)Br

STK586499
Synonyms: 7- ethoxy- 9- (methylsulfanyl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCOc1nc(SC)nc2c1sc1c2c2CCCc2c(n1)C(C)C

STK586503
Synonyms: 2- (2- bromophenyl)- 12- (3,4- dimethoxyphenyl)- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- ol
Smiles: COc1ccc(cc1OC)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)c1ccccc1Br)O

STK586504
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccccc1)c1nccnc1

STK586506
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 8,9- diphenyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl]ethanol
Smiles: OCCn1c(c2ccccc2)c(c2c1ncn1c2nc(n1)c1ccc(c(c1)OC)OC)c1ccccc1

STK586508
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- fluorophenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1COc1ccccc1

STK586510
Synonyms: N- (4- methylphenyl)- 2- [(11- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCC(=O)Nc1ccc(cc1)C)nn2

STK586511
Synonyms: N- (4- methoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK586513
Synonyms: (2'S,3S,3'S,10b'R)- 3'- {[4- (propan- 2- yloxy)phenyl]carbonyl}- 2'- [(4- propylphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(C)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586514
Synonyms: 2- (3- methoxyphenyl)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2

STK586515
Synonyms: N- (3- chloro- 4- methylphenyl)- N'- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)ethanediamide
Smiles: O=C(C(=O)NCC1COc2c(O1)cccc2)Nc1ccc(c(c1)Cl)C

STK586516
Synonyms: methyl5- acetyl- 2- ({(Z)- 2- cyano- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)- 4- methylthiophene- 3- carboxylate
Smiles: N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C(=O)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK586517
Synonyms: N- (3- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1c1cccc(c1)Cl

STK586518
Synonyms: 2- hydroxy- 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 7- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccc(cc1)O)O

STK586519
Synonyms: (4E)- 2- (3,4- dimethylphenyl)- 4- ({[(1- ethylpyrrolidin- 2- yl)methyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(c(c1)C)C

STK586520
Synonyms: N- (4- chlorophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK586521
Synonyms: N- [(2Z)- 3- (5- chloro- 2,4- dimethoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1cc(Cl)c(cc1OC)OC)CS(=O)(=O)C2

STK586522
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- 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)/C(=C(/c1ccc3c(c1)OCCO3)\[O-])/C(=O)C(=O)N2CC[NH+]1CCOCC1

STK586523
Synonyms: 4- bromo- N- [(3E)- 1- ethyl- 8- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)Br)/c2c1nc1c(C)cccc1c2

STK586524
Synonyms: 2,3- diphenyl- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: O=c1n(c2ccccc2)c(nc2c1c(=O)c1c(o2)cccc1)c1ccccc1

STK586525
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (2,3- dichlorophenyl)- 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: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1Cl)Cl)C(=O)Nc1c2cccc1

STK586526
Synonyms: (2S)- N- (2- fluorophenyl)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: Fc1ccccc1NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)C

STK586527
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- difluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2F)F)nnc1COc1ccc(cc1)Cl

STK586528
Synonyms: 2- imino- 1,10- dimethyl- N- (2- methylpropyl)- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CC(CNC(=O)c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)C

STK586529
Synonyms: 4- ({N- [(3- tert- butyl- 5,9- dimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)acetyl]- L- isoleucyl}amino)butanoicacid
Smiles: CC[C@H]([C@@H](C(=O)NCCCC(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)C

STK586531
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- yl(2S)- {[(benzyloxy)carbonyl]amino}(phenyl)ethanoate
Smiles: O=C(N[C@@H](c1ccccc1)C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)OCc1ccccc1

STK586532
Synonyms: 5- (2- methoxyphenyl)- 4- {[(E)- (4- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C

STK586533
Synonyms: (E)- {2- (2,5- dimethoxyphenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}[3- fluoro- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1)OC

STK586534
Synonyms: 3- (2- ethoxyethyl)- 1- methyl- 8- (2- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK586535
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 8- {[4- (2- hydroxyethyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCN1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK586538
Synonyms: 6- chloro- N- [(2Z)- 6- fluoro- 1,3- benzothiazol- 2(3H)- ylidene]- 7- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Fc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cc(c(c3)Cl)C)/[nH]2

STK586541
Synonyms: 1- [(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]propan- 2- ol
Smiles: CC(CNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)O

STK586542
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)- 6- (4- chlorophenyl)- 3- (4- methoxyphenyl)- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- epoxy[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]1O[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Cl

STK586543
Synonyms: 10- methyl- N- [3- (propan- 2- yloxy)propyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)C(=O)NCCCOC(C)C

STK586546
Synonyms: 8- (2- aminophenyl)- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Nc1ccccc1n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK586549
Synonyms: ethyl5- methyl- 4- phenyl- 2- [(pyrrolidin- 1- ylacetyl)amino]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCCC2)sc(c1c1ccccc1)C

STK586550
Synonyms: 6- (3- fluorobenzyl)- 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)c1n2Cc1cccc(c1)F

STK586551
Synonyms: 2- {[3- cyano- 6- hydroxy- 4- (2- methylphenyl)- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (4- nitrophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])N=C(CC1c1ccccc1C)O

STK586552
Synonyms: N- [4- ({(1E)- 1- [4- hydroxy- 1- (2- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/C

STK586553
Synonyms: N- [3- (3,4- dichlorophenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]butanamide
Smiles: CCCC(=O)Nc1c(c2ccc(c(c2)Cl)Cl)c(=O)c2c(n1C)cccc2

STK586554
Synonyms: N- (4- nitrophenyl)- 6- (4- oxoquinazolin- 3(4H)- yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCCCCn1cnc2c(c1=O)cccc2

STK586555
Synonyms: 8- [(2E)- 2- (2- chloro- 6- fluorobenzylidene)hydrazinyl]- 7- ethyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCn1c(N/N=C/c2c(F)cccc2Cl)nc2c1c(O)nc(=O)n2C

STK586556
Synonyms: 8- (azepanium- 1- ylmethyl)- 3- (naphthalen- 2- yloxy)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCCC1)oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK586557
Synonyms: 2- {[4- ethyl- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- phenoxyphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)Oc1ccccc1

STK586559
Synonyms: 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK586560
Synonyms: (4E)- 4- [hydroxy(5- methylfuran- 2- yl)methylidene]- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1ccccc1

STK586562
Synonyms: 4- ({[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK586563
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(3- nitrophenyl)carbonyl]- 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)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3)c1cccs1

STK586566
Synonyms: ethyl2- [1- (2- fluorophenyl)- 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(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK586567
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 4- oxo- 8- (pyrrolidinium- 1- ylmethyl)- 4H- chromen- 7- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCC1)occ(c2=O)c1nc2c(s1)cccc2

STK586568
Synonyms: 2- (azepan- 1- yl)- 9- methyl- 4- oxo- 4H- pyrido[1,2- a]pyrimidine- 3- carbaldehyde
Smiles: O=Cc1c(nc2n(c1=O)cccc2C)N1CCCCCC1

STK586569
Synonyms: 2- (6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (3- hydroxypropyl)acetamide
Smiles: Cc1c(CC(=O)NCCCO)c(=O)oc2c1cc(Cl)c(c2)OC

STK586571
Synonyms: (3- methoxyphenyl)(3,5,6,7- tetrahydro- 1'H- spiro[imidazo[4,5- c]pyridine- 4,4'- piperidin]- 1'- yl)methanone
Smiles: COc1cccc(c1)C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK586573
Synonyms: N- (3- ethyl- 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: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)NC(=O)C)C(=O)N(C)C(=O)N(C1=O)C

STK586574
Synonyms: 2- (1H- indol- 3- yl)- N- [1- (4- methoxyphenyl)- 2- phenylethyl]- N- methyl- 2- oxoacetamide
Smiles: COc1ccc(cc1)C(N(C(=O)C(=O)c1c[nH]c2c1cccc2)C)Cc1ccccc1

STK586575
Synonyms: 2- (methylsulfanyl)- 9- (2,3,4- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nc2n(n1)C(C1=C(O)CCCC1=N2)c1ccc(c(c1OC)OC)OC

STK586576
Synonyms: 2- (ethylsulfanyl)- 5- methyl- 6- (naphthalen- 1- ylmethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCSc1nn2c(n1)nc(c(c2O)Cc1cccc2c1cccc2)C

STK586578
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK586580
Synonyms: N- (3,4- difluorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1c1cccc(c1)C

STK586581
Synonyms: 9- [2- (3,4- dimethoxyphenyl)ethyl]- 3- ethyl- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: COc1cc(CCN2CCCn3c2nc2c3c(=O)n(c(=O)n2C)CC)ccc1OC

STK586582
Synonyms: (5Z)- 5- {[1- (4- bromonaphthalen- 1- yl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 3- cyclohexyl- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/c2cc(n(c2C)c2ccc(c3c2cccc3)Br)C)/C(=O)N1C1CCCCC1

STK586584
Synonyms: (2Z)- N- (4- fluorophenyl)- 4- hydroxy- 2- [(2E)- (4- methoxybenzylidene)hydrazinylidene]- 5,6- dihydro- 2H- 1,3- thiazine- 6- carboxamide
Smiles: COc1ccc(cc1)/C=N/N=C\1/N=C(O)CC(S1)C(=O)Nc1ccc(cc1)F

STK586585
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 5- nitrobenzaldehyde
Smiles: O=Cc1cc(ccc1N1CCN(CC1)c1ccccc1F)[N+](=O)[O-]

STK586586
Synonyms: N- [(4- methoxyphenyl)carbamoyl]- L- leucine
Smiles: COc1ccc(cc1)NC(=O)N[C@H](C(=O)O)CC(C)C

STK586588
Synonyms: 2- [4- (4- methoxyphenyl)piperazin- 1- yl]- 6- methyl- 5- (3- methylbutyl)pyrimidin- 4- ol
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc(C)c(c(n1)O)CCC(C)C

STK586589
Synonyms: 2- {[5- (3- chlorophenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1cccc(c1)Cl

STK586592
Synonyms: 2- [(6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)oxy]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1ccc2c(c1)oc(=O)c1c2CCCC1

STK586593
Synonyms: (5E)- 6- hydroxy- 3- (2- methylphenyl)- 5- [1- (piperidin- 1- ylamino)propylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NN1CCCCC1

STK586594
Synonyms: (E)- [3- fluoro- 4- (propan- 2- yloxy)phenyl]{1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxo- 2- (3,4,5- trimethoxyphenyl)pyrrolidin- 3- ylidene}methanolate
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK586595
Synonyms: 9- methoxy- 6- [2- (pentyloxy)benzyl]- 6H- indolo[2,3- b]quinoxaline
Smiles: CCCCCOc1ccccc1Cn1c2ccc(cc2c2c1nc1ccccc1n2)OC

STK586598
Synonyms: 3- cyclohexyl- N- [4- methoxy- 3- (propan- 2- yloxy)benzyl]- 3- [4- (propan- 2- yloxy)phenyl]propan- 1- amine
Smiles: COc1ccc(cc1OC(C)C)CNCCC(c1ccc(cc1)OC(C)C)C1CCCCC1

STK586600
Synonyms: 2- amino- 1- (2- aminoethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carbonitrile
Smiles: NCCn1c2nc3ccccc3nc2c(c1N)C#N

STK586601
Synonyms: 7- hydroxy- 2,5- dimethylpyrazolo[1,5- a]pyrimidine- 3- carbonitrile
Smiles: N#Cc1c(C)nn2c1nc(C)cc2O

STK586604
Synonyms: N- [4,6- dioxo- 1- (pyridin- 2- ylmethyl)- 2- sulfanyl- 5- (trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)Nc2c1c(=O)nc(n2Cc1ccccn1)S)C(F)(F)F

STK586605
Synonyms: 4- chloro- N- [(2E)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]- 3- nitrobenzamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)/[nH]2

STK586607
Synonyms: N- (3- chlorophenyl)- 4- (4- methylphenyl)- 1- [4- (propan- 2- yl)phenyl]- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)C(C)C)CCCC3)c1ccc(cc1)C

STK586608
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- ethoxyphenyl)carbonyl]- 3'- [(4- fluorophenyl)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(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586609
Synonyms: N- benzyl- 4- methoxy- 1H- indole- 2- carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCc1ccccc1

STK586610
Synonyms: N- (furan- 2- ylmethyl)- 3- methoxy- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1ccco1

STK586612
Synonyms: [1- (4- chlorophenyl)cyclopentyl](5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)methanone
Smiles: Clc1ccc(cc1)C1(CCCC1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1

STK586613
Synonyms: 3- benzyl- 3'- tert- butyl- 6'- hydroxy- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: O=C1N=C(O)C2(C(=O)N1C(C)(C)C)Cc1ccccc1N1C2CN(CC1)Cc1ccccc1

STK586614
Synonyms: 8- {[benzyl(methyl)ammonio]methyl}- 3- (2- bromophenoxy)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F)Cc1ccccc1

STK586615
Synonyms: 3,6- diamino- N- (2- chloro- 4- fluorophenyl)- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccc(cc1Cl)F

STK586617
Synonyms: 5- (4- bromophenyl)- 3- (2- hydroxyphenyl)- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: OC(=O)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1O

STK586618
Synonyms: N- (4- butylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)OC

STK586622
Synonyms: N'- [(E)- (4- methoxyphenyl)methylidene]- 5- [4- (pentyloxy)phenyl]- 1H- pyrazole- 3- carbohydrazide
Smiles: CCCCCOc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)OC

STK586623
Synonyms: 8,8- dimethyl- 2- (4- nitrophenyl)- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridin- 1- amine
Smiles: [O-][N+](=O)c1ccc(cc1)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1

STK586625
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (pyridin- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccnc1)c(=O)c1c(o2)cccc1

STK586626
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK586628
Synonyms: N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}- 4- phenoxybenzamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1ccc(cc1)Oc1ccccc1)nn2)C(F)(F)F

STK586629
Synonyms: N- benzyl- 2- {[2- (3- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)NCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK586630
Synonyms: 4- ({(E)- [4- (diethylamino)phenyl]methylidene}amino)- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCN(c1ccc(cc1)/C=N/n1c(n[nH]c1=S)c1ccc(cc1)F)CC

STK586631
Synonyms: 1- hydroxy- N- (2- methoxyethyl)- 1H- benzimidazole- 2- carboxamide3- oxide
Smiles: COCCNC(=O)c1n(O)c2c([n+]1[O-])cccc2

STK586632
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK586633
Synonyms: 6- chloro- 2- oxo- 4- propyl- 2H- chromen- 7- yl2- {[(4- methylphenyl)sulfonyl]amino}butanoate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C(NS(=O)(=O)c1ccc(cc1)C)CC

STK586635
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc2c(c1)OCCO2

STK586636
Synonyms: (2Z)- 7- {[benzyl(methyl)ammonio]methyl}- 2- [4- (methoxycarbonyl)benzylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](Cc1ccccc1)C)[O-]

STK586637
Synonyms: N- (1,3- dimethyl- 2,4,6- trioxo- 1,1',2',3,3',3a',4,6- octahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 7'- yl)acetamide
Smiles: CC(=O)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK586638
Synonyms: (3R,3'S,5'R)- 5- chloro- N- (2,5- dimethoxyphenyl)- 7- methyl- 2- oxo- 5'- (propan- 2- yl)- 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(C)C)OC

STK586639
Synonyms: (3a'S,6a'R)- 5'- (1,3- benzodioxol- 5- ylmethyl)- 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)Cc1ccc3c(c1)OCO3)C(O)C)C(=O)N2

STK586642
Synonyms: 7- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 2- ethyl- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2n1nc(cc1C)C)C

STK586643
Synonyms: 1- (1,3- dimethyl- 2,4,6- trioxo- 1,1',2',3,3',3a',4,6- octahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 7'- yl)- 3- ethylthiourea
Smiles: CCNC(=S)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK586644
Synonyms: N- [(3Z)- 8- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2- nitrobenzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1c(c2)cccc1C

STK586645
Synonyms: (5E)- 5- (1- {[4- (diethylamino)phenyl]amino}propylidene)- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(c1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC)CC

STK586646
Synonyms: (4Z)- 2- (2- chloro- 5- nitrophenyl)- 4- (3- methoxy- 4- propoxybenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: CCCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cc(ccc1Cl)[N+](=O)[O-]

STK586647
Synonyms: 6- [(E)- {(2Z)- [5- (2- {[4- (ethoxycarbonyl)phenyl]amino}- 2- oxoethyl)- 4- hydroxy- 1,3- thiazol- 2(5H)- ylidene]hydrazinylidene}methyl]- 2,3- dimethoxybenzoicacid
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N\N=C\c2ccc(c(c2C(=O)O)OC)OC)/N=C1O

STK586649
Synonyms: 7- chloro- 3- ethyl- 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: CCN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=O)N(CC(C)C)C(=O)N(C1=O)CC(C)C

STK586651
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCNCC1)COc1ccc(cc1)C

STK586653
Synonyms: 2- ([1]benzofuro[3,2- d]pyrimidin- 4- ylsulfanyl)cyclohexanone
Smiles: O=C1CCCCC1Sc1ncnc2c1oc1c2cccc1

STK586654
Synonyms: 3- (3- chloro- 4- methylphenyl)- 2,6- dihydroxy- 5- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)pyrimidin- 4(3H)- one
Smiles: O=C1OC(c2c1cccc2)c1c(O)nc(n(c1=O)c1ccc(c(c1)Cl)C)O

STK586655
Synonyms: (4- chlorophenyl)(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)Cl

STK586656
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (2- fluorophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK586658
Synonyms: N- [(2Z)- 3- (3,4- dimethoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- ethylbutanamide
Smiles: CCC(C(=O)/N=C/1\SC2C(N1Cc1ccc(c(c1)OC)OC)CS(=O)(=O)C2)CC

STK586660
Synonyms: 6- benzyl- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2n(c(c1Cc1ccccc1)O)ncc2c1ccccc1

STK586665
Synonyms: (3a'S,6a'R)- 5'- butyl- 7- chloro- 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)Nc2c1cccc2Cl

STK586666
Synonyms: N- [2- (4- chlorophenyl)- 4- (4- methoxyphenyl)- 6- methyl- 5- oxo- 2,5- dihydropyridazin- 3- yl]- 2- methylpropanamide
Smiles: COc1ccc(cc1)c1c(NC(=O)C(C)C)n(nc(c1=O)C)c1ccc(cc1)Cl

STK586668
Synonyms: ethyl2- ({[(2R)- 1- methoxy- 1- oxopropan- 2- yl]carbamoyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)N[C@@H](C(=O)OC)C

STK586672
Synonyms: methylN- [(2,4- dimethoxyphenyl)carbamoyl]- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1OC)OC)CC(C)C

STK586673
Synonyms: 7- chloro- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3Cl)C

STK586674
Synonyms: 3- [2- (4- benzylpiperidin- 1- yl)- 2- oxoethyl]quinazolin- 4(3H)- one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)Cn1cnc2c(c1=O)cccc2

STK586675
Synonyms: (4E)- 5- (4- bromophenyl)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(cc1)Br

STK586676
Synonyms: 8- (2- methoxyphenyl)- 1- methyl- 3- (2- methylbenzyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1C

STK586677
Synonyms: 2,8,10- trimethyl- 4- (4- methylpiperazin- 1- yl)pyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK586678
Synonyms: 1- (3,4- dimethylphenyl)- N- (4- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(c2ccc(c(c2)C)C)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

STK586680
Synonyms: (3a'R,8b'S)- 2'- tert- butyl- 7- chloro- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: O=C1[C@@H]2C3CCCN3C3([C@@H]2C(=O)N1C(C)(C)C)C(=O)Nc1c3cccc1Cl

STK586681
Synonyms: 6,7- dimethoxy- 2- [(4- methoxyphenyl)sulfonyl]- 1- methyl- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCc2c(C1C)cc(c(c2)OC)OC

STK586683
Synonyms: 9a- [(E)- 2- {4- [(2,4- dichlorobenzyl)oxy]- 3- ethoxyphenyl}ethenyl]- 7,9,9- trimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1Cl)Cl)/C=C/C12NC(=O)CN1c1c(C2(C)C)cc(cc1)C

STK586684
Synonyms: N- (2- tert- butylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1ccccn1

STK586686
Synonyms: 2- (2,4- dibromophenoxy)- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Oc2ccc(cc2Br)Br)nc1=O

STK586687
Synonyms: N- (3- chlorophenyl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1COc1ccccc1

STK586688
Synonyms: 9- (4- ethylphenyl)- 1- methyl- 3- [2- (piperidin- 1- yl)ethyl]- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK586690
Synonyms: 6- benzyl- 2- (benzylsulfanyl)- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)SCc1ccccc1

STK586691
Synonyms: N- [4- (benzyloxy)phenyl]- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1C)c1cccc(c1)Cl

STK586694
Synonyms: (E)- (4- fluorophenyl){2- (4- hydroxyphenyl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: Oc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)F)/[O-]

STK586696
Synonyms: (5E)- 3- (4- chlorophenyl)- 5- {1- [(2,5- dimethoxyphenyl)amino]propylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/Nc1cc(OC)ccc1OC

STK586702
Synonyms: (2- benzylphenyl)(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccccc1Cc1ccccc1

STK586703
Synonyms: N- [3- (2- chlorophenyl)- 1- ethyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]furan- 2- carboxamide
Smiles: CCn1c(NC(=O)c2ccco2)c(c2ccccc2Cl)c(=O)c2c1cccc2

STK586704
Synonyms: 2- (1,1- dioxido- 3- oxo- 1,2- benzothiazol- 2(3H)- yl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- methylacetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)CN1C(=O)c2c(S1(=O)=O)cccc2

STK586705
Synonyms: 1- (4- ethylphenyl)- N- (2- methoxyphenyl)- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccccc2OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)OC

STK586706
Synonyms: 4- {[(E)- (2- nitrophenyl)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/c1ccccc1[N+](=O)[O-]

STK586708
Synonyms: 2- chloro- N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)acetamide
Smiles: ClCC(=O)NC1C=CS(=O)(=O)C1

STK586709
Synonyms: (5Z)- 5- (3,4- dimethoxybenzylidene)- 2- methyl- 3- (naphthalen- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1ccc(cc1OC)/C=C/1\N=C(N(C1=O)c1ccc2c(c1)cccc2)C

STK586710
Synonyms: N'- [1- (2,2- dimethyl- 4- phenyltetrahydro- 2H- pyran- 4- yl)propan- 2- yl]- N,N- diethylpropane- 1,3- diamine
Smiles: CCN(CCCNC(CC1(CCOC(C1)(C)C)c1ccccc1)C)CC

STK586711
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (3- methylbutyl)hexanamide
Smiles: CC(CCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK586713
Synonyms: (5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)[4- (piperidin- 1- ylsulfonyl)phenyl]methanone
Smiles: O=C(N1CCc2c(C1=C)cc1c(c2)OCO1)c1ccc(cc1)S(=O)(=O)N1CCCCC1

STK586720
Synonyms: (3E)- 3- (furan- 2- ylmethylidene)- 4- imino- 8- (methylsulfonyl)- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1ccco1)ccc(c3)S(=O)(=O)C

STK586721
Synonyms: 4- (2,3- dichlorophenyl)- 2- (ethylsulfanyl)- 5- hydroxy- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1cccc(c1Cl)Cl

STK586722
Synonyms: 4- [7- (4- methylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]phenol
Smiles: Cc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1ccc(cc1)O

STK586723
Synonyms: (2Z)- 1- (4- chlorophenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(cc3)Cl)/NCCc2cc1OC

STK586727
Synonyms: 8- (3- chlorophenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: Clc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK586728
Synonyms: 3- chloro- N- (3- methyl- 1- phenyl- 1H- pyrazol- 5- yl)quinoxalin- 2- amine
Smiles: Cc1cc(n(n1)c1ccccc1)Nc1nc2ccccc2nc1Cl

STK586731
Synonyms: (4E)- 5- [4- (benzyloxy)- 3- ethoxyphenyl]- 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: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1)C

STK586732
Synonyms: 2- {5- [(3,4- dimethylbenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(c(c2)C)C)nnc1c1nccnc1

STK586735
Synonyms: (3S,3'S,3a'R,6a'S)- 5- chloro- 3'- (3,4- dihydroxybenzyl)- 7- methyl- 5'- (tetrahydrofuran- 2- 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: Clc1cc(C)c2c(c1)[C@]1(N[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)CC1CCCO1)Cc1ccc(c(c1)O)O)C(=O)N2

STK586736
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK586737
Synonyms: 2- (2- chlorophenyl)- 3- (4- fluorophenyl)- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Fc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1Cl

STK586738
Synonyms: 3- {(Z)- [3- (3- methoxypropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 7- methyl- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O

STK586739
Synonyms: 1,3- dimethyl- 7- (3- methylbutyl)- 8- [(2- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C)C

STK586741
Synonyms: ethyl2- amino- 5'- fluoro- 1'- methyl- 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(F)cc1)C)C(=O)CCC2

STK586742
Synonyms: 1'- cyclohexyl- 9- methyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[benzo[g]pyrido[1,2- a][1,8]naphthyridine- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Cc1ccc2c(c1)cc1c(n2)N2CCCCC2C2(C1)C(=O)NC(=O)N(C2=O)C1CCCCC1

STK586743
Synonyms: 10- methoxy- 7- (3- nitrobenzyl)- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1cccc(c1)[N+](=O)[O-]

STK586744
Synonyms: 12- chloro- 3- (tetrahydrofuran- 2- ylmethyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: Clc1cc2c(c3c1OCN(C3)CC1CCCO1)oc(=O)c1c2CCCC1

STK586745
Synonyms: N'- [(1Z)- 3- amino- 1H- isoindol- 1- ylidene]tricyclo[3.3.1.1~3,7~]decane- 1- carbohydrazide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)N/N=C/1\N=C(c2c1cccc2)N

STK586747
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- (3- hydroxyphenyl)pyrrolidine- 2,3- dione
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK586748
Synonyms: 5- (4- tert- butylphenyl)- 6- (1- hydroxy- 2- methylpropan- 2- yl)- 1,3- dimethyl- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: OCC(n1cc2c(c1c1ccc(cc1)C(C)(C)C)c(=O)n(c(=O)n2C)C)(C)C

STK586751
Synonyms: 4- {[(E)- (3- fluorophenyl)methylidene]amino}- 5- (2- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK586752
Synonyms: 4- methyl- 1'- (2- methylphenyl)- 3,4- dihydro- 1H,2'H- spiro[benzo[f]quinoline- 2,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: CN1CC2(Cc3c1ccc1c3cccc1)C(=O)NC(=O)N(C2=O)c1ccccc1C

STK586753
Synonyms: 4- [(4- {(5Z)- 2,4- dioxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 1,3- thiazolidin- 3- yl}butanoyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCCN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O

STK586754
Synonyms: 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1COc1ccc(cc1)C

STK586755
Synonyms: 5- (2- chlorophenyl)- 4- ({(E)- [2- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1C(F)(F)F

STK586756
Synonyms: (3S,3'S,3a'R,6a'S)- 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)Nc2c1cccc2

STK586757
Synonyms: (3a'S,6a'R)- 5- fluoro- 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)Nc2c1cc(F)cc2

STK586758
Synonyms: 2- (10- methoxy- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)- N- (2- phenylethyl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)NCCc1ccccc1

STK586759
Synonyms: (4Z)- 2- (4- chlorophenyl)- 4- [2- (4- methoxyphenyl)- 4H- chromen- 4- ylidene]- 1,3- oxazol- 5(4H)- one
Smiles: COc1ccc(cc1)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)Cl)/c2c(O1)cccc2

STK586760
Synonyms: 2- chloro- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- ylN- (tert- butoxycarbonyl)norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)NC(=O)OC(C)(C)C

STK586763
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2CC)nnc1COc1ccc(cc1)Cl

STK586766
Synonyms: 2- (ethylsulfanyl)- 5- hydroxy- 4- [4- (propan- 2- yl)phenyl]- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(cc1)C(C)C

STK586767
Synonyms: 3- benzyl- 2- (2- chlorophenyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Clc1ccccc1c1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccccc1

STK586768
Synonyms: N- (2,5- dimethylphenyl)- 2,2- dimethyl- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]propanamide
Smiles: Cc1ccc(c(c1)N(C(=O)C(C)(C)C)Cc1cc2cccc(c2[nH]c1=O)C)C

STK586769
Synonyms: 8- [(2- fluorophenyl)sulfonyl]- 7- methyl- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1ccccc1F

STK586770
Synonyms: 3'- tert- butyl- 6'- hydroxy- 3- methyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CN1CCN2C(C1)C1(Cc3c2cccc3)C(=NC(=O)N(C1=O)C(C)(C)C)O

STK586771
Synonyms: 2- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 7- methyl- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)ccc(c1)C

STK586773
Synonyms: 2- (4,6- dimethyl- 1,3- benzothiazol- 2- yl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK586774
Synonyms: 7- fluoro- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1- (4- methylphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK586775
Synonyms: 3- [(3a'S,6a'R)- 7- chloro- 5'- (2- methoxyethyl)- 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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2Cl

STK586776
Synonyms: 4- {[(E)- (3- bromo- 4- methoxyphenyl)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(c(c1)Br)OC

STK586778
Synonyms: 6- hydroxy- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 8- (propan- 2- ylsulfanyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=C)Cn1c(SC(C)C)nc2c1c(O)nc(=O)n2C

STK586779
Synonyms: 4- {[(E)- (4- chloro- 3- nitrophenyl)methylidene]amino}- 5- phenyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccccc1

STK586780
Synonyms: 2- (2- {[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK586781
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (4- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OC

STK586782
Synonyms: [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl](6- methoxy- 1H- indol- 2- yl)methanone
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK586783
Synonyms: N- [3- (2- methoxyphenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]butanamide
Smiles: CCCC(=O)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1OC

STK586784
Synonyms: (4E)- 5- (3,4- dimethoxyphenyl)- 4- {hydroxy[4- (2- methylpropoxy)phenyl]methylidene}- 1- (2- methoxyethyl)pyrrolidine- 2,3- dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC(C)C)/O)/C1c1ccc(c(c1)OC)OC

STK586785
Synonyms: (E)- {2- [4- (benzyloxy)- 3- ethoxyphenyl]- 1- [2- (dimethylammonio)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(2,3- dihydro- 1,4- benzodioxin- 6- yl)methanolate
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK586787
Synonyms: 2- (9- methoxy- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)OC

STK586788
Synonyms: N,N- dimethyl- N'- [4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- yl]ethane- 1,2- diamine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCCN(C)C)C

STK586790
Synonyms: 2,2- dimethyl- 8- (piperazin- 1- yl)- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCNCC1)C

STK586791
Synonyms: 8- (ethylamino)- 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C

STK586795
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)Cc2cccs2)cc(c1)OC

STK586796
Synonyms: N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]- 4- methoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1cc2c([nH]1)cccc2OC

STK586797
Synonyms: N- (2,3- dimethylphenyl)- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- 3- nitrobenzamide
Smiles: Cc1cccc(c1C)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2cccc(c2[nH]c1=O)C

STK586798
Synonyms: 3- (4- chlorobenzyl)- 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)Cc1ccc(cc1)Cl

STK586799
Synonyms: 2- [(4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1ccc2c(c1C)oc(=O)cc2C

STK586800
Synonyms: N- [6- chloro- 3- (4- fluorophenyl)- 4- oxo- 4H- chromen- 2- yl]- 2- phenylacetamide
Smiles: O=C(Nc1oc2ccc(cc2c(=O)c1c1ccc(cc1)F)Cl)Cc1ccccc1

STK586801
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 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)COc1ccccc1

STK586802
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2CC)nnc1COc1ccc(cc1)Cl

STK586803
Synonyms: 3- methyl- 1'- (4- methylpentyl)- 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(CCCN1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(C)CC1)C

STK586804
Synonyms: N- (4- bromo- 3- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK586806
Synonyms: 1- (3- methoxyphenyl)- 3- (phenylsulfonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: COc1cccc(c1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccccc1

STK586807
Synonyms: (5Z)- 5- [(1- benzyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C(=N1)O

STK586808
Synonyms: 2- (1,3- benzoxazol- 2- ylamino)- 7,7- dimethyl- 4- (4- methylphenyl)- 4,6,7,8- tetrahydroquinazolin- 5- ol
Smiles: Cc1ccc(cc1)C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK586809
Synonyms: 3- [4- (ethoxycarbonyl)phenoxy]- 2- methyl- 8- [(2- methylpiperidinium- 1- yl)methyl]- 4- oxo- 4H- chromen- 7- olate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCCC1C)[O-]

STK586810
Synonyms: 10- [4- (dimethylamino)phenyl]- 5- (4- methoxyphenyl)- 1,3,7,7- tetramethyl- 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)c1c2c(c3n1C(C)(C)COC3c1ccc(cc1)N(C)C)n(C)c(=O)n(c2=O)C

STK586812
Synonyms: N'- [(E)- (4- ethoxyphenyl)methylidene]- 4,5,6- trimethoxy- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK586813
Synonyms: N- benzyl- 2- {[3- cyano- 5- hydroxy- 4- (4- hydroxy- 3- methoxyphenyl)- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NCc2ccccc2)N=C2C(=C(O)CCC2)C1c1ccc(c(c1)OC)O

STK586816
Synonyms: (4E)- 2- (3,4- dimethylphenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\NCCCN1CCOCC1)cccc2

STK586817
Synonyms: 6,7- dimethoxy- 2- [(2,4,6- trimethylphenyl)sulfonyl]- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1c(C)cc(cc1C)C

STK586819
Synonyms: (6E)- 5- imino- 2- (pyridin- 4- yl)- 6- (1H- pyrrol- 2- ylmethylidene)- 5,6- dihydro- 7H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 7- one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccc[nH]1)c1ccncc1

STK586822
Synonyms: 5- [3- (6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)- 5- (2- fluorophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccccc1F)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK586823
Synonyms: 5- (4- fluorophenyl)- 4- {[(1E,2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1/C=C/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK586824
Synonyms: N- [(2E)- 5- [(E)- 2- (4- chlorophenyl)ethenyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- phenoxypropanamide
Smiles: Clc1ccc(cc1)/C=C/c1n[nH]/c(=N\C(=O)C(Oc2ccccc2)C)/s1

STK586825
Synonyms: [4- (difluoromethoxy)- 3- ethoxyphenyl](7- methyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)methanone
Smiles: CCOc1cc(ccc1OC(F)F)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK586826
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (2- fluorophenyl)hexanamide
Smiles: O=C(Nc1ccccc1F)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK586827
Synonyms: (3S,3a'R,8a'S,8b'S)- 5- chloro- 7- methyl- 2'- (4- methylphenyl)- 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: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STK586828
Synonyms: 7- chloro- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- [4- (propan- 2- yl)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)C(C)C)c(=O)c1c(o2)cc(c(c1)Cl)C

STK586829
Synonyms: (3a'R,8b'S)- 5- chloro- 2'- (2- methoxyethyl)- 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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(Cl)cc2

STK586832
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (2,4- dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2Cl)Cl)N=C2C(=C(O)CCC2)C1c1ccco1

STK586833
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccco1

STK586834
Synonyms: 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1- (2- fluorophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK586836
Synonyms: 3- cyclohexyl- N- (4- methoxybenzyl)- 3- [4- (propan- 2- yloxy)phenyl]propan- 1- amine
Smiles: COc1ccc(cc1)CNCCC(c1ccc(cc1)OC(C)C)C1CCCCC1

STK586838
Synonyms: (2E)- 3- (3- chlorophenyl)- 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)prop- 2- en- 1- one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C=C/c1cccc(c1)Cl

STK586841
Synonyms: N- [(2Z)- 3- (2- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenylacetamide
Smiles: COc1ccccc1CN1/C(=N/C(=O)Cc2ccccc2)/SC2C1CS(=O)(=O)C2

STK586844
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nnc1COc1ccccc1

STK586845
Synonyms: 4- {[({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetyl]amino}benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK586846
Synonyms: 3- (benzylsulfanyl)- 8,8- dimethyl- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridine- 6- carbonitrile
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccccc1)c(SCc1ccccc1)nn2

STK586847
Synonyms: 2- [(4Z)- 3- oxo- 4- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)butan- 2- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)C)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK586848
Synonyms: 1- (3- chloro- 4- methylphenyl)- 2'- ethyl- 6'- nitro- 1'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCN1c2ccc(cc2CC2(C1CC)C(=O)NC(=O)N(C2=O)c1ccc(c(c1)Cl)C)[N+](=O)[O-]

STK586849
Synonyms: 7- benzyl- 8- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccccc1N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK586850
Synonyms: 2- [(2,4- difluorophenyl)sulfonyl]- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1ccc(cc1F)F

STK586851
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 5- (4- methylphenyl)- 1- (prop- 2- en- 1- yl)pyrrolidine- 2,3- dione
Smiles: C=CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Br)/O)/C1c1ccc(cc1)C

STK586854
Synonyms: 1- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}propan- 2- one
Smiles: CC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK586855
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- 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)c1n[nH]c(c1)c1ccc(cc1)F

STK586857
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- [4- (trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc(cc1)OC(F)(F)F

STK586858
Synonyms: N- [(2Z)- 3- (2,4- difluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: Fc1ccc(c(c1)F)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2

STK586859
Synonyms: 2- chloro- 5- {5- [(Z)- (2- hydroxy- 5- oxo- 1- phenyl- 1,5- dihydro- 4H- imidazol- 4- ylidene)methyl]furan- 2- yl}benzoicacid
Smiles: OC1=N/C(=C\c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C(=O)N1c1ccccc1

STK586861
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2cccc(c2)Cl)cc(c1)OC

STK586862
Synonyms: N~2~- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- D- asparagine
Smiles: O=C(C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)N[C@@H](C(=O)O)CC(=O)N

STK586863
Synonyms: 2- ethyl- 1- (3- fluorophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCN1C(=O)c2c(C1c1cccc(c1)F)c(=O)c1c(o2)cccc1

STK586864
Synonyms: 2- fluoro- N- [4- (3- methoxyphenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: COc1cccc(c1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1F)c1ccc(cc1)C

STK586865
Synonyms: 7- chloro- 1- (3,4- dichlorophenyl)- 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)Cl

STK586866
Synonyms: tert- butyl[(1S)- 1- {5- [(3- fluorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)Cc1cccc(c1)F)C

STK586867
Synonyms: 7- fluoro- 2- (2- hydroxyethyl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)F

STK586868
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK586872
Synonyms: 3- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 6- methyl- N- (1,3- thiazol- 2- yl)heptanamide
Smiles: CC(CCC(C1CCOC(C1)(C)C)CC(=O)Nc1nccs1)C

STK586875
Synonyms: 2- {[2- (3- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- phenylacetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)Nc2ccccc2)c2c(n1)CC(OC2)(C)C

STK586877
Synonyms: 5,7- dichloro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (4- propoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK586881
Synonyms: 3- [4- (phenylcarbonyl)piperazin- 1- yl]- 1- (propan- 2- yl)- 6,7- dihydro- 5H- cyclopenta[c]pyridine- 4- carbonitrile
Smiles: N#Cc1c(nc(c2c1CCC2)C(C)C)N1CCN(CC1)C(=O)c1ccccc1

STK586886
Synonyms: N- {(1Z)- 1- [1- cyano- 2- (morpholin- 4- yl)- 2- oxoethylidene]- 1H- isoindol- 3- yl}- 2- methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1C)/C(=O)N1CCOCC1

STK586887
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethyl- 6- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1c(C)cccc1CC

STK586888
Synonyms: 4- {[(E)- (2- ethoxyphenyl)methylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccccc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK586890
Synonyms: N- (2- methylpropyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]furan- 2- carboxamide
Smiles: CC(CN(C(=O)c1ccco1)Cc1cc2ccccc2[nH]c1=O)C

STK586891
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1

STK586892
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- [(4- methylpiperidinium- 1- yl)methyl]- 4- oxo- 4H- chromen- 7- olate
Smiles: CC1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1nc2c(s1)cccc2

STK586893
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- chlorophenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1c1ccc(cc1)C(C)(C)C

STK586894
Synonyms: 4- {[(2E)- 2- (acetylamino)- 3- phenylprop- 2- enoyl]amino}butanoicacid
Smiles: O=C(/C(=C\c1ccccc1)/NC(=O)C)NCCCC(=O)O

STK586895
Synonyms: N- [3- (naphthalen- 1- yl)- 4- oxo- 4H- chromen- 2- yl]benzamide
Smiles: O=C(c1ccccc1)Nc1oc2ccccc2c(=O)c1c1cccc2c1cccc2

STK586896
Synonyms: (5Z)- 5- {[2,5- dimethyl- 1- (4- methylphenyl)- 1H- pyrrol- 3- yl]methylidene}- 1- (3- methoxyphenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1cccc(c1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)C)C)/C1=O)S

STK586899
Synonyms: N- [(2Z)- 3- (2,4- dimethoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1OC)OC)CS(=O)(=O)C2

STK586900
Synonyms: 6,8- dibromo- 2,4- dihydroxy- N- (prop- 2- en- 1- yl)quinoline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK586902
Synonyms: 2- (methylamino)- 3- {(Z)- [4- oxo- 3- (3- phenylpropyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCc1ccccc1

STK586903
Synonyms: N- [3- (1,3- benzodioxol- 5- yl)- 6- chloro- 4- oxo- 4H- chromen- 2- yl]thiophene- 2- carboxamide
Smiles: Clc1ccc2c(c1)c(=O)c(c(o2)NC(=O)c1cccs1)c1ccc2c(c1)OCO2

STK586904
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(3,5- dimethylphenyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]- 3,4- dimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(c(c1)OC)OC)/C(=O)Nc1cc(C)cc(c1)C

STK586905
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- yl6- [(tert- butoxycarbonyl)amino]hexanoate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)CCCCCNC(=O)OC(C)(C)C

STK586907
Synonyms: ethyl2- {[(Z)- (6- hydroxy- 4- oxo- 2- sulfanylpyrimidin- 5(4H)- ylidene)methyl]amino}- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NC(=NC2=O)S)O)sc2c1CCCCC2

STK586908
Synonyms: 2- {[2- (diethylamino)ethyl]amino}- 3- (furan- 2- ylmethyl)- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCN(CCNc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCCC3)CC

STK586909
Synonyms: N- [5- (acetylamino)- 2- methoxyphenyl]- 2- {[4- (4- ethoxyphenyl)- 5- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(ccc2OC)NC(=O)C)nnc1c1ccccc1

STK586910
Synonyms: 11- cyclohexyl- 3- heptyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2C1CCCCC1

STK586911
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- butyl- 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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cc(Br)cc2

STK586916
Synonyms: (2Z)- 2- [(2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK586919
Synonyms: 6,7- dimethyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- [3- (prop- 2- en- 1- yloxy)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: C=CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK586922
Synonyms: 5,7- dimethyl- 4- [(2- methylpiperidin- 1- yl)methyl]- 2H- chromen- 2- one
Smiles: Cc1cc(C)c2c(c1)oc(=O)cc2CN1CCCCC1C

STK586923
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- (3- ethoxy- 4- propoxyphenyl)pyrrolidine- 2,3- dione
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK586924
Synonyms: 3- [6- (morpholin- 4- yl)- 6- oxohexyl]- 1,2,3- benzotriazin- 4(3H)- one
Smiles: O=C(N1CCOCC1)CCCCCn1nnc2c(c1=O)cccc2

STK586925
Synonyms: 5- (3,4,5- trimethoxyphenyl)- 4- {[(E)- (2,3,4- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1c(OC)ccc(c1OC)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK586926
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1ccccc1Cl

STK586928
Synonyms: (4E)- 5- (4- ethoxyphenyl)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK586929
Synonyms: N- [(2Z)- 3- (3,5- dichlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: Clc1cc(Cl)cc(c1)N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK586930
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 3- [(Z)- (4- oxo- 3- propyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O

STK586934
Synonyms: 4- [3- (2,4- dichlorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- N,N- dimethylaniline
Smiles: Clc1ccc(c(c1)Cl)c1nnc2n1nc(s2)c1ccc(cc1)N(C)C

STK586935
Synonyms: (3R)- N- (2- methoxyethyl)- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: COCCNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK586937
Synonyms: ethyl2- amino- 5'- methoxy- 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)Nc1c3cc(OC)cc1)C(=O)CCC2

STK586938
Synonyms: 5- ethyl- 7- (4- methylphenyl)benzimidazo[1',2':1,6]pyrimido[4,5- b]quinolin- 14(5H)- one
Smiles: CCn1c2nc(c3ccc(cc3)C)n3c(c2c(=O)c2c1cccc2)nc1c3cccc1

STK586939
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1cc(Cl)ccc1C

STK586940
Synonyms: ethyl6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (2- ethoxyphenyl)- 2- hydroxy- 3,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1C(=NC(=C(C1c1ccccc1OCC)C#N)SCC(=O)Nc1ccc(c(c1)Cl)C)O

STK586942
Synonyms: 1- amino- 4- (phenylamino)- 2- (pyrrolidin- 1- yl)anthracene- 9,10- dione
Smiles: O=C1c2ccccc2C(=O)c2c1c(Nc1ccccc1)cc(c2N)N1CCCC1

STK586944
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- methoxy- 5- methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C)C

STK586946
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)pyridine- 3- carboxamide
Smiles: CC(CN(C(=O)c1cccnc1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK586947
Synonyms: N'- [(E)- (2- chloro- 6- methoxyquinolin- 3- yl)methylidene]pyridine- 4- carbohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)c1ccncc1

STK586948
Synonyms: N- (3- chlorophenyl)- 4- [(4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)methyl]cyclohexanecarboxamide
Smiles: Clc1cccc(c1)NC(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK586949
Synonyms: (1'R,2'R)- 1'- acetyl- 2'- (2,5- dimethoxyphenyl)- 7'- methyl- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)OC

STK586950
Synonyms: [(1R,4aS,8aS)- 1- (2,4- dimethoxyphenyl)- 4a- hydroxyoctahydroisoquinolin- 2(1H)- yl](2- fluorophenyl)methanone
Smiles: COc1cc(OC)ccc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)c1ccccc1F

STK586952
Synonyms: 2- [(3a'S,6a'R)- 5'- cyclohexyl- 5- fluoro- 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)C1CCCCC1)C(=O)Nc1c2cc(F)cc1

STK586953
Synonyms: (2E)- N- [(2Z)- 5- (ethylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- (furan- 2- yl)prop- 2- enamide
Smiles: CCS(=O)(=O)c1n[nH]/c(=N/C(=O)/C=C/c2ccco2)/s1

STK586954
Synonyms: 4- (9- hydroxy- 7,7- dimethyl- 11- oxo- 7,8,10,11- tetrahydro- 6H- indeno[1,2- b]quinolin- 10- yl)phenylphenyl(phenylsulfanyl)acetate
Smiles: OC1=C2C(=NC3=C(C2c2ccc(cc2)OC(=O)C(c2ccccc2)Sc2ccccc2)C(=O)c2c3cccc2)CC(C1)(C)C

STK586955
Synonyms: N- [(4- ethoxyphenyl)carbamoyl]- L- leucine
Smiles: CCOc1ccc(cc1)NC(=O)N[C@H](C(=O)O)CC(C)C

STK586957
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK586958
Synonyms: (4E)- 2- (2,5- dimethoxyphenyl)- 4- {[(3- methylbutyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/NCCC(C)C)/c2c(C1=O)cccc2)OC

STK586959
Synonyms: 2- {5- [(3- fluorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)F)nnc1c1ccccn1

STK586960
Synonyms: 4- {[(E)- (4- chloro- 3- nitrophenyl)methylidene]amino}- 5- (4- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

STK586961
Synonyms: 1- (4- chlorophenyl)- 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(cc1)Cl)c(=O)c1c(o2)cccc1

STK586964
Synonyms: 3- [(4- tert- butylbenzyl)sulfanyl]- 5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1cccc(c1)Cl

STK586965
Synonyms: 4- hydroxy- 8- (2- hydroxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purin- 2(6H)- one
Smiles: Oc1ccccc1N1CCn2c1nc1c2c(O)nc(=O)n1C

STK586966
Synonyms: 3- (pyridin- 3- ylmethyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1CCCC2)Cc1cccnc1

STK586968
Synonyms: 4- {[({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetyl]amino}benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK586969
Synonyms: 2- [4- (4- fluorophenyl)piperazin- 1- yl]- N- [(2Z)- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: Fc1ccc(cc1)N1CCN(CC1)CC(=O)/N=c/1\scc([nH]1)c1ccccc1

STK586970
Synonyms: (4E)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}- 2- (2- fluorophenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1/C(=C/NC2CCS(=O)(=O)C2)/c2ccccc2C(=O)N1c1ccccc1F

STK586971
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[4- (prop- 2- en- 1- yl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1Cc1cccs1

STK586972
Synonyms: 1- methyl- 8- (2- methylphenyl)- 3- (2- phenylethyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Cc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK586973
Synonyms: N'- {(1E)- 1- [4- hydroxy- 1- (4- methoxyphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/CC

STK586975
Synonyms: 6- (4- chlorophenyl)- 9- (4- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccc(cc1)Cl

STK586976
Synonyms: N,N- dibutyl- 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: CCCCN(C(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1)CCCC

STK586978
Synonyms: 3- {(2S)- 1- [4- (4- fluorophenyl)piperazin- 1- yl]- 1- oxopropan- 2- yl}- 1,2,3- benzotriazin- 4(3H)- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK586979
Synonyms: 2- {[6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- 1- (4- nitrophenyl)ethanone
Smiles: CSc1nc(SCC(=O)c2ccc(cc2)[N+](=O)[O-])c2c(n1)sc1c2CC(OC1)(C)C

STK586980
Synonyms: 3- cyclohexyl- 2- (4- methoxyphenyl)- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: COc1ccc(cc1)c1nc2c(c(=O)n1C1CCCCC1)c(=O)c1c(n2C)cccc1

STK586981
Synonyms: N,N- diethyl- N'- (5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl)propane- 1,3- diamine
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCCN(CC)CC

STK586984
Synonyms: 2- hydroxy- 3- methyl- 6- [(2E)- 1- methyl- 2- (pyridin- 4- ylmethylidene)hydrazinyl]pyrimidin- 4(3H)- one
Smiles: CN(c1nc(O)n(c(=O)c1)C)/N=C/c1ccncc1

STK586985
Synonyms: (4E)- 2- (2,3- dimethylphenyl)- 4- ({[(1- ethylpyrrolidin- 2- yl)methyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(c1C)C

STK586986
Synonyms: 5- (2,3- dichlorophenyl)- 2- (4- methoxyphenyl)- 4- phenyl- 1H- imidazole
Smiles: COc1ccc(cc1)c1[nH]c(c(n1)c1ccccc1)c1cccc(c1Cl)Cl

STK586988
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)acetamide
Smiles: COc1cc(CCNC(=O)Cn2c3ccccc3c3c2c(=O)n2CCCSc2n3)ccc1OC

STK586990
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinoline
Smiles: CCN1CCN(CC1)c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK586993
Synonyms: ethyl2- [1- (4- chlorophenyl)- 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)Cl)c(=O)c1c(o2)cccc1

STK586994
Synonyms: ethyl4- [3- (2- amino- 2- oxoethyl)- 1,7- dimethyl- 2,4- dioxo- 1,2,3,4,7,8- hexahydropyrimido[2,1- f]purin- 9(6H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)N

STK586996
Synonyms: 3- (2- methoxyethyl)- 8- (3- methoxyphenyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)c1cccc(c1)OC)C

STK586998
Synonyms: (2E)- 3- (1,3- benzodioxol- 5- yl)- 1- [2- (4- methoxyphenyl)- 6,7- dihydro[1,3]thiazolo[5,4- c]pyridin- 5(4H)- yl]prop- 2- en- 1- one
Smiles: COc1ccc(cc1)c1nc2c(s1)CN(CC2)C(=O)/C=C/c1ccc2c(c1)OCO2

STK586999
Synonyms: 8- (3,5- dimethylphenyl)- 4- hydroxy- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purin- 2(6H)- one
Smiles: Cc1cc(C)cc(c1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK587000
Synonyms: 8- (dimethylamino)- 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N(C)C)COc1ccc(cc1)C

STK587002
Synonyms: (4E)- 5- (4- bromophenyl)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 1- methylpyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)Br)N(C(=O)C1=O)C)/O

STK587003
Synonyms: (4Z)- 2- (2,4- dimethylphenyl)- 4- {[(4- hydroxyphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: Oc1ccc(cc1)N/C=C\1/c2ccccc2C(=O)N(C1=O)c1ccc(cc1C)C

STK587004
Synonyms: 4- ({[trans- 4- ({[3- (5- methyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]amino}methyl)cyclohexyl]carbonyl}amino)butanoicacid
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)NCCCC(=O)O

STK587005
Synonyms: N- (4- bromophenyl)- 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK587007
Synonyms: 4- {[(E)- (5- methylfuran- 2- yl)methylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(o1)C

STK587008
Synonyms: 2- amino- 1- [3- (dimethylamino)propyl]- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCCN(C)C

STK587009
Synonyms: 4- {(2E)- 2- [(2- hydroxy- 7- methoxyquinolin- 3- yl)methylidene]hydrazinyl}benzoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/Nc1ccc(cc1)C(=O)O)O

STK587010
Synonyms: 6'- chloro- 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: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(Cl)cccc1N1C2CCC1

STK587011
Synonyms: 6,8- dibromo- 2,4- dihydroxy- N- (3- hydroxypropyl)quinoline- 3- carboxamide
Smiles: OCCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK587014
Synonyms: 2- [4- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- 4- oxobutyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)CCCN1C(=O)c2c(C1=O)cccc2

STK587016
Synonyms: N- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- D- methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1

STK587017
Synonyms: (1'R,2'R)- 2'- (3- chlorophenyl)- 1'- [(2- chlorophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Clc1cccc(c1)[C@H]1[C@H](C(=O)c2ccccc2Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK587018
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nnc1COc1ccc(cc1)Cl

STK587019
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 1- methyl- 3- nitroquinolin- 2(1H)- one
Smiles: Cn1c(=O)c([N+](=O)[O-])c(c2c1cccc2)N1CCC(CC1)Cc1ccccc1

STK587020
Synonyms: 5- (2- methylpropyl)- 8- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinoline
Smiles: CC(Cc1nc2oc3c(c2c2c1CCCC2)ncnc3N1CCOCC1)C

STK587021
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dimethoxyphenyl)carbonyl]- 2'- [(4- methylphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)cccc3

STK587022
Synonyms: N- (2- ethyl- 6- methylphenyl)- 2- ({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C)C

STK587023
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK587024
Synonyms: trans- 4- {[({[(2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: O=C(COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O)NC[C@@H]1CC[C@H](CC1)C(=O)O

STK587026
Synonyms: methyl{8- [(4- benzylpiperidin- 1- yl)methyl]- 1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl}acetate
Smiles: COC(=O)Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK587028
Synonyms: 6- chloro- 7- hydroxy- 4- phenyl- 8- {[(pyridin- 4- ylmethyl)amino]methyl}- 2H- chromen- 2- one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c(CNCc1ccncc1)c(c(c2)Cl)O

STK587029
Synonyms: 4- (2- chlorophenyl)- 5- hydroxy- 2- (methylsulfanyl)- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccccc1Cl

STK587030
Synonyms: N- [(2Z)- 4- (4- methoxyphenyl)- 1,3- thiazol- 2(3H)- ylidene]- 4- (2- oxo- 2H- chromen- 3- yl)benzamide
Smiles: COc1ccc(cc1)c1cs/c(=N\C(=O)c2ccc(cc2)c2cc3ccccc3oc2=O)/[nH]1

STK587032
Synonyms: N- [(2Z)- 3- benzyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (2- chlorophenyl)acetamide
Smiles: O=C(Cc1ccccc1Cl)/N=C/1\SC2C(N1Cc1ccccc1)CS(=O)(=O)C2

STK587033
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK587034
Synonyms: 3- (4- chlorobenzyl)- 9- (4- chlorophenyl)- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)Cl

STK587036
Synonyms: 7- fluoro- 1- (4- methoxyphenyl)- 2- (6- methylpyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK587037
Synonyms: 7- methoxy- 3- (2- sulfanylethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: SCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)OC

STK587039
Synonyms: 4- [(E)- {(2E)- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2(3H)- ylidene]hydrazinylidene}methyl]phenol
Smiles: Oc1ccc(cc1)/C=N/N=c\1/scc([nH]1)c1ccc(cc1Cl)Cl

STK587040
Synonyms: 4- {[(E)- (2- fluorophenyl)methylidene]amino}- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1F

STK587042
Synonyms: methyl4- [7- chloro- 6- methyl- 3,9- dioxo- 2- (pyridin- 2- yl)- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK587043
Synonyms: 3- [(2,4- dichlorobenzyl)oxy]- 1- hydroxy- 5- methyl- 9H- xanthen- 9- one
Smiles: Clc1ccc(c(c1)Cl)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK587044
Synonyms: 6- {[3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanoyl]amino}hexanoicacid
Smiles: O=C(CCn1nnc2c(c1=O)cccc2)NCCCCCC(=O)O

STK587045
Synonyms: 8- (2- methoxyphenyl)- 1- methyl- 3- (3- methylbutyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK587046
Synonyms: 1- benzyl- 6- cyclopentyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCC1)Cc1ccccc1

STK587048
Synonyms: N- (4- bromophenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1COc1ccc(cc1)Cl

STK587050
Synonyms: 4- [2- chloro- 5- (trifluoromethyl)phenyl]- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cc(ccc1Cl)C(F)(F)F)c1cccnc1

STK587051
Synonyms: 6- butyl- 2- methyl- 4- (4- methylphenyl)pyridazino[3',4':4,5]pyrimido[1,6- a]benzimidazol- 1(4H)- one
Smiles: CCCCc1nc2n(nc(c(=O)c2c2n1c1ccccc1n2)C)c1ccc(cc1)C

STK587052
Synonyms: (4Z)- 2- (3- bromophenyl)- 4- (3,4- diethoxybenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: CCOc1cc(ccc1OCC)/C=C/1\N=C(OC1=O)c1cccc(c1)Br

STK587053
Synonyms: [2- chloro- 5- (methylsulfanyl)phenyl](6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: CSc1ccc(c(c1)C(=O)N1CCc2c(C1)cc(c(c2)OC)OC)Cl

STK587055
Synonyms: 3- (2- bromophenoxy)- 8- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 4- oxo- 4H- chromen- 7- olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)Oc1ccccc1Br

STK587057
Synonyms: N- [(2Z)- 3- (3- chloro- 4- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK587058
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (3- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1cccc(c1)OC

STK587060
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (2- chloro- 5- nitrophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccccc1Br)[N+](=O)[O-]

STK587061
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CC(COc1cccc(c1)C)O)c(=O)n(c(=O)n2C)C

STK587064
Synonyms: 6- cyclopentyl- 1- (4- methylphenyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Cc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C1CCCC1

STK587066
Synonyms: 9- (3- methoxyphenyl)- 1- methyl- 3- [2- (morpholin- 4- yl)ethyl]- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: COc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK587067
Synonyms: 5- cyclopropyl- N'- [(1E)- 1- (2- hydroxyphenyl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C1CC1)N/N=C(/c1ccccc1O)\C

STK587071
Synonyms: 8- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 7- (2- methoxyethyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK587072
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK587073
Synonyms: N- [4- (dimethylamino)phenyl]- 4- [(4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1nnc2c(c1=O)cccc2)Nc1ccc(cc1)N(C)C

STK587074
Synonyms: N- (2,6- dimethylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1Cc1cccs1

STK587075
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (2,5- dimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl)OC

STK587076
Synonyms: 2- {[6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: CSc1nc(SCC(=O)Nc2cccc(c2)C)c2c(n1)sc1c2CC(OC1)(C)C

STK587077
Synonyms: 2- [5- (3,4- dichlorophenyl)furan- 2- yl]- 4- imino- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1ccc(o1)c1ccc(c(c1)Cl)Cl

STK587079
Synonyms: 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1c1ccccc1)c1cnccn1

STK587080
Synonyms: (E)- 1- (2- chlorophenyl)- 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}methanimine
Smiles: Clc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK587085
Synonyms: 2- ({3- cyano- 5- hydroxy- 4- [4- (propan- 2- yl)phenyl]- 4,6,7,8- tetrahydroquinolin- 2- yl}sulfanyl)acetamide
Smiles: N#CC1=C(SCC(=O)N)N=C2C(=C(O)CCC2)C1c1ccc(cc1)C(C)C

STK587086
Synonyms: 2- fluoro- N- {1- methyl- 4- oxo- 3- [3- (trifluoromethyl)phenyl]- 1,4- dihydroquinolin- 2- yl}benzamide
Smiles: O=C(c1ccccc1F)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F

STK587088
Synonyms: methyl3- ({[1- phenyl- 3- (thiophen- 2- yl)- 1H- pyrazol- 4- yl]carbonyl}amino)- 1H- 1,2,4- triazole- 5- carboxylate
Smiles: COC(=O)c1[nH]nc(n1)NC(=O)c1cn(nc1c1cccs1)c1ccccc1

STK587090
Synonyms: 2'- hydroxy- 1'- methyl- 15,16- dihydro- 4'H,4bH,6H,7H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1- a]isoquinoline- 5,5'- pyrimidine]- 4',6',7(1'H)- trione
Smiles: OC1=NC(=O)C2(C(=O)N1C)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK587091
Synonyms: 8- benzyl- 1,6,7- trimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cn1c(=O)n(CCN2CCCCC2)c(=O)c2c1nc1n2c(c(n1Cc1ccccc1)C)C

STK587093
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- chlorophenyl)carbonyl]- 3'- [(4- chlorophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK587095
Synonyms: 5- (2- chlorophenyl)- 4- ({(E)- [4- (dimethylamino)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(C)C

STK587096
Synonyms: 1- (4- fluorophenyl)- 4- (4- nitrophenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1COC2=O)c1ccc(cc1)[N+](=O)[O-]

STK587097
Synonyms: (3a'S,6a'R)- 3'- (3,4- dihydroxybenzyl)- 5'- (2- methoxyethyl)- 5,7- 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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(C)cc2C

STK587101
Synonyms: 6- chloro- 4- propyl- 9- (3,4,5- trimethoxybenzyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)Cc1cc(OC)c(c(c1)OC)OC

STK587102
Synonyms: (1'R,2'S)- 2'- (2- chlorophenyl)- 1'- [(4- chlorophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1Cl)C(=O)c1c(C2=O)cccc1

STK587103
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK587104
Synonyms: 2- {[3- cyano- 6- (3,4- dimethoxyphenyl)pyridin- 2- yl]sulfanyl}- N- [(2E)- 5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CCSc1n[nH]/c(=N\C(=O)CSc2nc(ccc2C#N)c2ccc(c(c2)OC)OC)/s1

STK587105
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 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)c1ccc(cc1)F

STK587108
Synonyms: (4E)- 2- (4- chlorophenyl)- 4- [(methylamino)methylidene]isoquinoline- 1,3(2H,4H)- dione
Smiles: CN/C=C\1/C(=O)N(c2ccc(cc2)Cl)C(=O)c2c1cccc2

STK587111
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (5- chloro- 2- methylphenyl)- 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)c1cc(Cl)ccc1C

STK587112
Synonyms: 6- (2- hydroxyphenyl)- 9- (2- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Oc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2C)ncn3)C1)O

STK587118
Synonyms: ethyl2- [1- (3- ethoxyphenyl)- 3,9- dioxo- 3,9- dihydrochromeno[2,3- c]pyrrol- 2(1H)- yl]- 1,3- benzothiazole- 6- carboxylate
Smiles: CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C(=O)OCC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK587120
Synonyms: 11- methyl- 3- (3- methylphenyl)- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: Cc1cccc(c1)C1CC(=C2C(=Nc3ccccc3N=C2C)C1)O

STK587121
Synonyms: (4E)- 2- (3- chlorophenyl)- 4- ({[(1- ethylpyrrolidin- 2- yl)methyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(c1)Cl

STK587123
Synonyms: 3- [(3a'S,6a'R)- 6- chloro- 5'- (4- chloro- 3- nitrophenyl)- 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]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(c(c1)[N+](=O)[O-])Cl)C(=O)Nc1c2ccc(c1C)Cl

STK587124
Synonyms: N- (4- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1C)c1cccc(c1)Cl

STK587126
Synonyms: 2- {[4- (prop- 2- en- 1- yl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1Cc1cccs1

STK587127
Synonyms: 3- benzyl- 2,6- dihydroxy- 5- [(2E)- 3- (1H- indol- 3- yl)prop- 2- enoyl]pyrimidin- 4(3H)- one
Smiles: O=C(c1c(O)nc(n(c1=O)Cc1ccccc1)O)/C=C/c1c[nH]c2c1cccc2

STK587129
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 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: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(F)cc2)C

STK587130
Synonyms: (5s,7s)- 5,7- diethyl- 2- (2- nitrophenyl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: CC[C@]12CN3C[C@@](C2O)(CN(C1)C3c1ccccc1[N+](=O)[O-])CC

STK587132
Synonyms: 3- [(4- iodophenyl)amino]- 2- benzofuran- 1(3H)- one
Smiles: Ic1ccc(cc1)NC1OC(=O)c2c1cccc2

STK587133
Synonyms: 5- {4- [(4- chlorobenzyl)oxy]phenyl}- N'- [(E)- naphthalen- 1- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Clc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1cccc2c1cccc2

STK587135
Synonyms: 2- (5,10- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)benzoicacid
Smiles: CC1CCc2c(C1)c1c(s2)nc(n2c1nc(n2)c1ccccc1C(=O)O)C

STK587136
Synonyms: 1'- butyl- 6- hydroxy- 6'- nitro- 3- phenyl- 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)c1ccccc1)O)[N+](=O)[O-]

STK587137
Synonyms: 9- (5- methyl- 1,2- oxazol- 3- yl)- 8- (pyridin- 2- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccccn1)c(=O)c1c(o2)c2ccccc2cc1

STK587139
Synonyms: 6- chloro- 3,4- dimethyl- 9- (2,4,6- trimethylphenyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: Cc1cc(C)c(c(c1)C)N1COc2c(C1)c1oc(=O)c(c(c1cc2Cl)C)C

STK587140
Synonyms: 5- amino- 11- (furan- 2- yl)- 9- oxo- 8- (pyridin- 3- yl)- 9,10,11,12- tetrahydro- 8H- quino[1,2- a]quinazoline- 7- carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccnc1)C(=O)CC(C2)c1ccco1)cccc3

STK587144
Synonyms: (3a'S,6a'R)- 5- fluoro- 3'- (4- hydroxybenzyl)- 5'- (4- methoxyphenyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(F)cc2

STK587146
Synonyms: 2- (3- methoxyphenyl)- 7,7- dimethyl- 4- {[2- (piperidin- 1- yl)ethyl]sulfanyl}- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: COc1cccc(c1)c1nc(SCCN2CCCCC2)c2c(n1)CC(OC2)(C)C

STK587148
Synonyms: 3- (pyridin- 4- ylmethyl)- 3,4- dihydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1cccc2)Cc1ccncc1

STK587149
Synonyms: 2'- (3- methoxyphenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cccc(c1)C1=NN2C(C1)c1ccccc1OC12CCN(CC1)C

STK587151
Synonyms: N- [(3Z)- 1- ethyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]pentanamide
Smiles: CCCCC(=O)/N=c/1\[nH]n(c2c1cc1ccc(cc1n2)C)CC

STK587152
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (4- fluorophenyl)- 5- (2- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: Fc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1[N+](=O)[O-]

STK587153
Synonyms: 10- methoxy- 7- [2- oxo- 2- (pyrrolidin- 1- yl)ethyl]- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)N1CCCC1

STK587157
Synonyms: 1- (4- chlorophenyl)- 4- phenyl- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)CC(C2=C1COC2=O)c1ccccc1

STK587160
Synonyms: N- (pyridin- 3- ylmethyl)[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: c1ccc(cn1)CNc1ncnc2c1oc1c2cccc1

STK587161
Synonyms: 3- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 2- hydroxy- 7- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccc(cc1Cl)Cl)O

STK587163
Synonyms: 1- (3- methylphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridazine- 3- carboxylicacid
Smiles: Cc1cccc(c1)N1N=C(CCC1=O)C(=O)O

STK587164
Synonyms: 8- [(2,5- dimethylphenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Cc1ccc(c(c1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1)C

STK587165
Synonyms: (4E)- 5- (2,4- dimethoxyphenyl)- 4- [hydroxy(phenyl)methylidene]- 1- (3- methylphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1cccc(c1)C

STK587166
Synonyms: N~5~,N~5~- dimethyl- 2,1,3- benzoxadiazole- 4,5- diamine
Smiles: CN(c1ccc2c(c1N)non2)C

STK587167
Synonyms: 2- {[4- (3,5- dichlorophenyl)- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl]methyl}phthalazin- 1(2H)- one
Smiles: Clc1cc(Cl)cc(c1)n1c(=S)[nH]nc1Cn1ncc2c(c1=O)cccc2

STK587169
Synonyms: ethyl2- [1- (4- fluorophenyl)- 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)F)c(=O)c1c(o2)cccc1

STK587170
Synonyms: 4- {[(E)- (3- chlorophenyl)methylidene]amino}- 5- (furan- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccco1

STK587171
Synonyms: (5s,7s)- 2- (2- chlorophenyl)- 5- ethyl- 7- methyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccccc1Cl)C

STK587173
Synonyms: 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK587174
Synonyms: 1- (3- chlorophenyl)- 6- cyclopentyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Clc1cccc(c1)n1c(S)nc(=O)c2c1NCN(C2)C1CCCC1

STK587175
Synonyms: 2- (7- methoxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (pyridin- 3- ylmethyl)acetamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)NCc1cccnc1

STK587176
Synonyms: (3a'S,6a'R)- 7- chloro- 5'- (2- chlorobenzyl)- 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: Oc1ccc(cc1)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl

STK587177
Synonyms: 8- {[benzyl(methyl)ammonio]methyl}- 4- oxo- 3- phenyl- 4H- chromen- 7- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1occ(c2=O)c1ccccc1)Cc1ccccc1

STK587178
Synonyms: N- (4- butylphenyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: CCCCc1ccc(cc1)NC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK587180
Synonyms: N- [(2Z)- 3- (4- bromo- 2,6- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: Brc1cc(C)c(c(c1)C)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2

STK587181
Synonyms: N'- [(E)- (4- methoxyphenyl)methylidene]- 5- [4- (naphthalen- 1- ylmethoxy)phenyl]- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1ccc(cc1)OCc1cccc2c1cccc2

STK587182
Synonyms: 4- chloro- N- (2- methylpropyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CC(CN(C(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2[nH]c1=O)C

STK587183
Synonyms: 8- methoxy- 3- (2- methoxyethyl)- 2- (3,4,5- trimethoxyphenyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1cc(OC)c(c(c1)OC)OC

STK587184
Synonyms: 2- ({[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)- 1H- benzimidazole
Smiles: Clc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1c1cccc(c1)Cl

STK587186
Synonyms: (4E)- 4- {[(4- methoxyphenyl)amino]methylidene}- 2- (6- methylpyridin- 2- yl)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1)N/C=C\1/C(=O)N(c2cccc(n2)C)C(=O)c2c1cccc2

STK587187
Synonyms: 5- (3,4- dichlorophenyl)- N'- [(1E)- 1- (3,4- dichlorophenyl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)N/N=C(/c1ccc(c(c1)Cl)Cl)\C

STK587188
Synonyms: (4E)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]- 5- (4- methylphenyl)pyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK587189
Synonyms: 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- fluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1COc1ccc(cc1)C

STK587190
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- dichlorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1Cl)Cl

STK587193
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- 1- (naphthalen- 2- yl)ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1COc1ccc(cc1)C

STK587194
Synonyms: 6- (2- phenylethyl)- 1- (pyridin- 3- ylmethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CCc1ccccc1)CN2)Cc1cccnc1

STK587195
Synonyms: 3- {(E)- [5- iminio- 3- (methylsulfanyl)- 7- oxo- 5H- [1,2,4]thiadiazolo[4,5- a]pyrimidin- 6(7H)- ylidene]methyl}- 4- oxo- 4H- chromen- 6- olate
Smiles: CSc1nsc2=NC(=O)/C(=C/c3coc4c(c3=O)cc(cc4)[O-])/C(=[NH2+])n12

STK587196
Synonyms: N- (4- chlorophenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1ccc(cc1)Cl

STK587197
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1cccc(c1)C

STK587198
Synonyms: 7- (4- chlorobenzyl)- 8- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

STK587199
Synonyms: N- (4- {(3E)- 2- (2- fluorophenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F

STK587201
Synonyms: 2- amino- 5- ethyl- 6- methyl- 4- (3,4,5- trimethoxyphenyl)pyridine- 3- carbonitrile
Smiles: COc1cc(cc(c1OC)OC)c1c(CC)c(C)nc(c1C#N)N

STK587202
Synonyms: 2- {[5- (3- chlorophenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2CC)nnc1c1cccc(c1)Cl

STK587203
Synonyms: 5- (4- fluorophenyl)- N'- [(1E)- 1- (naphthalen- 1- yl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Fc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C(/c1cccc2c1cccc2)\C

STK587207
Synonyms: 10- (3,4- dihydroxyphenyl)- 5- (4- methoxyphenyl)- 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: COc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccc(c(c1)O)O

STK587208
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1c1cccc(c1)C

STK587209
Synonyms: 7- (2,6- dimethylphenyl)- 3- (3- nitrophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: O=C1CC2(C(=O)N1c1c(C)cccc1C)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK587210
Synonyms: (4Z)- 4- [(3- methoxyphenyl)imino]- 6- (3- methyl- 1- benzofuran- 2- yl)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1cccc(c1)/N=c/1\nc(N)nc([nH]1)c1oc2c(c1C)cccc2

STK587211
Synonyms: 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 2- methyl- 4- oxo- 3- [4- (propoxycarbonyl)phenoxy]- 4H- chromen- 7- olate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCN(CC1)CCO)[O-]

STK587213
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)OC)nnc1c1cccc(c1)C

STK587214
Synonyms: 1- [10- (3,4- dimethoxyphenyl)- 2- (furan- 2- yl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1cc(ccc1OC)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccco1)C(=O)C

STK587217
Synonyms: 3- {5- chloro- 4- [(3,5- dimethoxyphenyl)amino]- 6- oxopyridazin- 1(6H)- yl}tricyclo[3.3.1.1~3,7~]decane- 1- carboxylicacid
Smiles: COc1cc(cc(c1)OC)Nc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2)(C3)C(=O)O

STK587218
Synonyms: 5- [2- (morpholin- 4- yl)ethyl]- N- [(2Z)- 4,6,8- trimethylquinazolin- 2(1H)- ylidene]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1cc(C)c2c(c1)c(C)n/c(=N\C1=NCN(CN1)CCN1CCOCC1)/[nH]2

STK587219
Synonyms: (5Z)- 3- benzyl- 6- hydroxy- 5- {1- [(2- phenylethyl)amino]propylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/NCCc1ccccc1

STK587220
Synonyms: 2- [3- (diethylamino)propyl]- 1- (2- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCN(CCCN1C(=O)c2c(C1c1ccccc1OC)c(=O)c1c(o2)cccc1)CC

STK587221
Synonyms: (4Z)- 4- (hydroxyimino)- 3,6,6- trimethyl- N- [2- (morpholin- 4- yl)ethyl]- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)NCCN1CCOCC1

STK587223
Synonyms: 2- (3,4- dimethoxyphenyl)- 3,5- dimethyl- 6- phenylpyrazine1,4- dioxide
Smiles: COc1cc(ccc1OC)c1c(C)[n+]([O-])c(c([n+]1[O-])c1ccccc1)C

STK587224
Synonyms: ethyl2- methoxy- 4- {(Z)- [2- (3- nitrophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cccc(c1)[N+](=O)[O-]

STK587225
Synonyms: 5- (2,4- dichlorophenyl)- 4- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1ccccc1O

STK587226
Synonyms: (4E)- 2- (4- methylphenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK587229
Synonyms: 6- methyl- 9- (2- phenylpropyl)- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: CC(c1ccccc1)CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK587230
Synonyms: N- (3,5- dichlorophenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK587231
Synonyms: N- [(3Z)- 7- methyl- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2,1,3- benzoxadiazole- 4- sulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2cccc3c2non3)/c2c1nc1cc(C)ccc1c2)C

STK587232
Synonyms: 2- [(8- chloro- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1cc2oc(=O)c3c(c2cc1Cl)CCC3

STK587234
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1C)c1cccc(c1)Cl

STK587235
Synonyms: (3R,3'S,5'S)- 5- chloro- N- (2,5- dimethoxyphenyl)- 5'- (2- methylpropyl)- 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)cc1)CC(C)C)OC

STK587236
Synonyms: N- [(3Z)- 1- ethyl- 6- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- nitrobenzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1ccc(cc1c2)C

STK587237
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- (prop- 2- en- 1- yloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK587238
Synonyms: 3- [3- (3,4- diethoxyphenyl)- 1,2,4- oxadiazol- 5- yl]- N- methylpropanamide
Smiles: CCOc1cc(ccc1OCC)c1noc(n1)CCC(=O)NC

STK587241
Synonyms: N- [(2R)- 2- (2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)- 3- (1H- indol- 3- yl)propanoyl]norleucine
Smiles: CCCCC(C(=O)O)NC(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2

STK587245
Synonyms: (3R)- N- {(2S)- 1- [(3- methoxyphenyl)amino]- 1- oxopropan- 2- yl}- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK587246
Synonyms: 5- (2- chlorobenzyl)- 2- [(4,6- dimethylquinazolin- 2- yl)amino]- 6- methylpyrimidin- 4- ol
Smiles: Cc1ccc2c(c1)c(C)nc(n2)Nc1nc(C)c(c(n1)O)Cc1ccccc1Cl

STK587247
Synonyms: 4- ({[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK587248
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STK587249
Synonyms: (3a'S,6a'R)- 5'- tert- butyl- 5- chloro- 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: Clc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)Cc1c[nH]c3c1cccc3)C(=O)N2

STK587250
Synonyms: propan- 2- yl({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetate
Smiles: COc1ccc(cc1)n1c(nnc1SCC(=O)OC(C)C)COc1ccc(cc1)Cl

STK587252
Synonyms: (3E)- 8- ethoxy- 4- imino- 3- ({1- [2- (2- methoxyphenoxy)ethyl]- 1H- pyrrol- 2- yl}methylidene)- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: CCOc1ccc2c(c1)sc1=NC(=O)/C(=C/c3cccn3CCOc3ccccc3OC)/C(=N)n21

STK587253
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1C)c1cccc(c1)Cl

STK587254
Synonyms: (10aS)- 2- (3- methoxyphenyl)- 10,10a- dihydroimidazo[1,5- b]isoquinoline- 1,3(2H,5H)- dione
Smiles: COc1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK587255
Synonyms: 4- {[(E)- (2- chloro- 6- fluorophenyl)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/c1c(F)cccc1Cl)C

STK587256
Synonyms: N- (2- ethylphenyl)- 2- ({4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2CC)nnc1COc1ccc(cc1)C

STK587257
Synonyms: 2,2- dimethyl- 5- (propan- 2- yl)- N- (pyridin- 3- ylmethyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1cccnc1)C

STK587260
Synonyms: 13- [4- (difluoromethoxy)- 3- ethoxyphenyl]- 9,10- dimethoxy- 3,3- dimethyl- 2,3,4,6,7,13- hexahydro- 1H- isoquino[2,1- a]quinolin- 1- one
Smiles: CCOc1cc(ccc1OC(F)F)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc(OC)c(c1)OC

STK587261
Synonyms: N- [(2E)- 3- (2- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 4- phenylbutanamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1F)CS(=O)(=O)C2)CCCc1ccccc1

STK587262
Synonyms: N- (5- chloro- 2,4- dimethoxyphenyl)- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: COc1cc(OC)c(cc1NC(=O)CCCn1cnc2c(c1=O)cccc2)Cl

STK587263
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK587264
Synonyms: (3S,3a'R,8a'S,8b'S)- 7- chloro- 5- methyl- 2'- phenyl- 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: Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1

STK587265
Synonyms: N- (4- chlorophenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Cl)nnc1c1ccccc1F

STK587267
Synonyms: N- (3- bromophenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1cccc(c1)Br)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK587268
Synonyms: N- (4- bromo- 3- methylphenyl)- 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK587269
Synonyms: 6- hydroxy- 3- methyl- 8- [(4- methyl- 1,3- thiazol- 2- yl)sulfanyl]- 7- (3- phenylpropyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1csc(n1)Sc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STK587270
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(c(c1)C)C

STK587271
Synonyms: 4- (8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK587273
Synonyms: 6- hydroxy- 3- methyl- 8- [(3- methylbutyl)sulfanyl]- 7- pentyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCn1c(SCCC(C)C)nc2c1c(O)nc(=O)n2C

STK587274
Synonyms: N- {2- [(3- chloro- 4- methoxyphenyl)carbonyl]- 1- benzofuran- 3- yl}- 2- (4- chlorophenoxy)acetamide
Smiles: COc1ccc(cc1Cl)C(=O)c1oc2c(c1NC(=O)COc1ccc(cc1)Cl)cccc2

STK587276
Synonyms: (2Z)- 2- (7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 5(6H)- ylidene)- 1- (3- methylthiophen- 2- yl)ethanone
Smiles: O=C(c1sccc1C)/C=C/1\NCCc2c1cc1OCOc1c2

STK587277
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (naphthalen- 1- yl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1COc1ccc(cc1)Cl

STK587279
Synonyms: 2- {[3- cyano- 5- hydroxy- 4- (4- hydroxy- 3- methoxyphenyl)- 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)C1c1ccc(c(c1)OC)O

STK587280
Synonyms: 3- (2- fluorophenyl)- 6'- hydroxy- 3'- (2- phenylethyl)- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: O=C1N=C(O)C2(C(=O)N1CCc1ccccc1)Cc1ccccc1N1C2CN(CC1)c1ccccc1F

STK587281
Synonyms: 4- {[(E)- (2- methoxynaphthalen- 1- yl)methylidene]amino}- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc2c(c1/C=N/n1c(=S)[nH]nc1c1ccccc1OC)cccc2

STK587282
Synonyms: 8- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK587284
Synonyms: 2- [(4- ethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- ylmethyl)acetamide
Smiles: CCc1cc(=O)oc2c1ccc(c2)OCC(=O)NCc1ccccn1

STK587286
Synonyms: 5- (4- methylphenyl)- 4- {[(E)- pyridin- 2- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccn1

STK587287
Synonyms: 2- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 1- (3- ethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)OCC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK587289
Synonyms: 4- {(Z)- [5- imino- 7- oxo- 2- (pyridin- 3- yl)- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 6(7H)- ylidene]methyl}- 2- methoxyphenyl4- methylbenzenesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1

STK587291
Synonyms: 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)- N- (2- methylphenyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccccc3C)nnc2c2c1CC(C)(C)OC2

STK587292
Synonyms: 5- (pyridin- 3- yl)- 4- {[(E)- (2,4,6- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)cc(c1/C=N/n1c(=S)[nH]nc1c1cccnc1)OC

STK587295
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK587296
Synonyms: (3S)- N- [(2S)- 1- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 4- methyl- 1- oxopentan- 2- yl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CC(C[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK587297
Synonyms: (3a'S,6a'R)- 3'- methyl- 5'- (2- phenylethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1

STK587299
Synonyms: 4- {[(E)- (2,6- dichlorophenyl)methylidene]amino}- 5- (2- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1c(Cl)cccc1Cl

STK587300
Synonyms: 9- (2- chlorophenyl)- 6- (2- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Oc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2Cl)ncn3)C1)O

STK587301
Synonyms: (5E)- 5- {[(1- benzylpiperidin- 4- yl)amino]methylidene}- 1- (4- methoxyphenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O)S

STK587304
Synonyms: 2- (4- chlorophenyl)- 3- (2- methoxyethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccc(cc1)Cl

STK587306
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 5- chloro- 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: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Cl)cc2)C

STK587307
Synonyms: [4- (azepan- 1- ylsulfonyl)phenyl](6,7- dimethoxy- 1- methylidene- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCCCCC1

STK587309
Synonyms: 8- (3- methoxyphenyl)- 1,6,7- trimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cccc(c1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK587310
Synonyms: N- (2- bromophenyl)- 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK587311
Synonyms: 2- cyclohexyl- 10- methyl- 3- (2- methylpropyl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CC(Cn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C1CCCCC1)C

STK587312
Synonyms: 2- fluoro- N- (7- methoxy- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)benzamide
Smiles: COc1ccc2c(c1)nc1c(c2)CCN1NC(=O)c1ccccc1F

STK587313
Synonyms: 1- {[1,3- dimethyl- 2,6- dioxo- 7- (3- oxobutan- 2- yl)- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]methyl}piperidine- 4- carboxamide
Smiles: CC(=O)C(n1c(CN2CCC(CC2)C(=O)N)nc2c1c(=O)n(c(=O)n2C)C)C

STK587314
Synonyms: N- (2- methoxy- 5- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1)C

STK587315
Synonyms: ethyl[(12- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(CC3)C

STK587317
Synonyms: 4- (4- chlorophenyl)- 1- (4- fluorophenyl)- N- (2- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(c2ccc(cc2)F)c2c3n1cc(n3CCCC2)c1ccc(cc1)Cl

STK587318
Synonyms: (3S)- N- [(2S)- 1- (1,3- benzodioxol- 5- ylamino)- 3- methyl- 1- oxobutan- 2- yl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)N[C@H](C(=O)Nc1ccc2c(c1)OCO2)C(C)C

STK587319
Synonyms: 3- (9- benzyl- 5- methyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)phenol
Smiles: Oc1cccc(c1)c1nc2n(n1)c(C)nc1c2c2CCN(Cc2s1)Cc1ccccc1

STK587321
Synonyms: 1',2,2,6'- tetramethyl- 1',4'- dihydro- 2'H- spiro[1,3- dioxane- 5,3'- quinoline]- 4,6- dione
Smiles: Cc1ccc2c(c1)CC1(CN2C)C(=O)OC(OC1=O)(C)C

STK587322
Synonyms: (3a'S,6a'R)- 3'- (1H- indol- 3- ylmethyl)- 5- methyl- 5'- (3- 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)c1cccc(c1)C)Cc1c[nH]c3c1cccc3)C(=O)N2

STK587323
Synonyms: N- [(2Z)- 3- (3- chloro- 4- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK587324
Synonyms: 7'- {[(E)- (2- hydroxy- 4,6- dioxo- 1- propyl- 1,6- dihydropyrimidin- 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: CCCN1C(=NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK587325
Synonyms: N- {4- [({[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]- 5- methoxy- 2- methylphenyl}benzamide
Smiles: COc1cc(NC(=O)c2ccccc2)c(cc1NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl)C

STK587326
Synonyms: (3S)- N- [(2S)- 1- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 1- oxopropan- 2- yl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)Nc1ccc2c(c1)OCCO2

STK587327
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1)C

STK587328
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK587329
Synonyms: 3- (2- methoxyethyl)- 2- (2- methylphenyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccccc1C

STK587330
Synonyms: 4- [4- (propan- 2- yl)phenyl]- 3,4,5,6- tetrahydrobenzo[h]quinazolin- 2- ol
Smiles: OC1=NC2=C(C(N1)c1ccc(cc1)C(C)C)CCc1c2cccc1

STK587331
Synonyms: 4- {[(E)- (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/c1ccccc1F

STK587333
Synonyms: 4- {[(E)- (5- bromothiophen- 2- yl)methylidene]amino}- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(s1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK587334
Synonyms: 1- {2- [4- (dimethylamino)phenyl]- 10- (4- methoxyphenyl)- 8- methyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl}ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccc(cc1)N(C)C)C(=O)C

STK587335
Synonyms: 3- (4- fluorophenyl)- 10- methyl- 2- (propan- 2- yl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Fc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C(C)C

STK587336
Synonyms: (5Z)- 3- (4- chlorophenyl)- 5- {1- [(4- fluorophenyl)amino]ethylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/C

STK587339
Synonyms: 4- {[(E)- (4- tert- butylphenyl)methylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)C

STK587340
Synonyms: 10- (2,4- dihydroxyphenyl)- 1,3,7,7- tetramethyl- 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: Oc1ccc(c(c1)O)C1OCC(n2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C)(C)C

STK587342
Synonyms: (2S)- N- [4- (acetylamino)phenyl]- 3- methyl- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK587343
Synonyms: N- [(2Z)- 5,5- dioxido- 3- [4- (trifluoromethoxy)phenyl]tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2,2- dimethylpropanamide
Smiles: O=C(C(C)(C)C)/N=C/1\SC2C(N1c1ccc(cc1)OC(F)(F)F)CS(=O)(=O)C2

STK587345
Synonyms: (4E)- 5- (3,4- dimethoxyphenyl)- 4- {hydroxy[4- (2- methylpropoxy)phenyl]methylidene}- 1- (3- methoxypropyl)pyrrolidine- 2,3- dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC(C)C)/O)/C1c1ccc(c(c1)OC)OC

STK587346
Synonyms: (6E)- 6- [(2,3- dichlorophenyl)imino]- 4- (3- methyl- 1- benzofuran- 2- yl)- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1[nH]/c(=N\c2cccc(c2Cl)Cl)/nc(n1)c1oc2c(c1C)cccc2

STK587349
Synonyms: N- benzyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline- 8(7H)- carbothioamide
Smiles: S=C(N1CCc2c(C1)cc1c(c2)OCCCO1)NCc1ccccc1

STK587350
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}propanamide
Smiles: O=C(CCc1ccc2c(c1)OCO2)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK587353
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 5- (3- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: Cc1nnc(s1)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK587354
Synonyms: 3- {3- [(5Z)- 5- (4- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 2,5- dioxopyrrolidin- 1- yl}propanoicacid
Smiles: OC(=O)CCN1C(=O)CC(C1=O)N1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O

STK587356
Synonyms: N- benzyl- 5,6- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NCc1ccccc1

STK587358
Synonyms: 2- chloro- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yltrans- 4- {[(tert- butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3

STK587359
Synonyms: (2Z)- 1- (5- methylfuran- 2- yl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)ethanone
Smiles: Cc1ccc(o1)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK587360
Synonyms: 1'- ethyl- 2,2,2'- trimethyl- 6'- nitro- 1',4'- dihydro- 2'H- spiro[1,3- dioxane- 5,3'- quinoline]- 4,6- dione
Smiles: CCN1c2ccc(cc2CC2(C1C)C(=O)OC(OC2=O)(C)C)[N+](=O)[O-]

STK587361
Synonyms: ethyl4- [({[4- amino- 5- (5- methyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)C

STK587362
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCOCC1)COc1ccc(cc1)C

STK587363
Synonyms: N- [(4- butylphenyl)carbamoyl]- L- alanine
Smiles: CCCCc1ccc(cc1)NC(=O)N[C@H](C(=O)O)C

STK587364
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)C)nnc1c1ccccn1

STK587368
Synonyms: 2- {[3- cyano- 4- (2- fluorophenyl)- 6- hydroxy- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)N=C(CC1c1ccccc1F)O

STK587370
Synonyms: 2- [(6- chloro- 3,4- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(COc1cc2oc(=O)c(c(c2cc1Cl)C)C)NCc1ccncc1

STK587371
Synonyms: 2- amino- 4- (decan- 2- yl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: CCCCCCCCC(C1C(=C(N)Oc2c1c(O)nc(c2)C)C#N)C

STK587372
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK587374
Synonyms: 7- methyl- 10- (pyridin- 2- ylmethyl)- 1,2,3,4,10,11- hexahydro- 5H,9H- benzo[3,4]chromeno[6,7- e][1,3]oxazin- 5- one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCCC2)Cc1ccccn1

STK587375
Synonyms: (5Z)- 3- butyl- 6- hydroxy- 5- [5- (4- methoxyphenyl)- 1- phenylpyrazolidin- 3- ylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCN1C(=O)N=C(/C(=C/2\CC(N(N2)c2ccccc2)c2ccc(cc2)OC)/C1=O)O

STK587376
Synonyms: (3a'S,6a'R)- 3'- (1H- indol- 3- ylmethyl)- 7- 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: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2C

STK587377
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- yl{1- [2- (dimethylammonio)ethyl]- 4,5- dioxo- 2- [3- (pentyloxy)phenyl]pyrrolidin- 3- ylidene}methanolate
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK587378
Synonyms: 2- methyl- N- [3- (morpholin- 4- yl)propyl]quinoline- 4- carboxamide
Smiles: Cc1nc2ccccc2c(c1)C(=O)NCCCN1CCOCC1

STK587379
Synonyms: 8- methoxy- 2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: COc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK587380
Synonyms: (2E)- 3- (2- chlorophenyl)- 1- (6,7- dimethoxy- 1- methylidene- 3,4- dihydroisoquinolin- 2(1H)- yl)prop- 2- en- 1- one
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)/C=C/c1ccccc1Cl

STK587381
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK587383
Synonyms: 12- (3,4- dimethoxyphenyl)- 10- [2- (3,4- dimethoxyphenyl)ethyl]- 10,12- dihydro- 11H- benzo[5,6]chromeno[2,3- d]pyrimidin- 11- imine
Smiles: COc1ccc(cc1OC)CCn1cnc2c(c1=N)C(c1ccc(c(c1)OC)OC)c1c(O2)ccc2c1cccc2

STK587385
Synonyms: 2- (3- bromophenyl)- 3- (2- methoxyethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cccc(c1)Br

STK587386
Synonyms: (3S)- N- {(2S)- 1- [(4- methoxybenzyl)amino]- 1- oxopropan- 2- yl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)[C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK587387
Synonyms: 6- (4- bromophenyl)- 2- methyl- 7- (pyridin- 3- yl)- 7,12- dihydro- 6H- chromeno[4,3- d][1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Brc1ccc(cc1)C1Oc2ccc(cc2C2=C1C(c1cccnc1)n1c(N2)ncn1)C

STK587388
Synonyms: N- (3- chlorophenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1c1cccc(c1)C

STK587389
Synonyms: N- [(2E)- 3- (1,3- benzodioxol- 5- yl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- phenylpropanamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2)CCc1ccccc1

STK587390
Synonyms: (3a'R,8b'S)- 5- chloro- 2'- (2- phenylethyl)- 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: Clc1ccc2c(c1)C1(C(=O)N2)N2CCCC2[C@@H]2[C@H]1C(=O)N(C2=O)CCc1ccccc1

STK587393
Synonyms: N- [4- (4- chlorophenyl)- 2- (3,4- dimethylphenyl)- 6- methyl- 5- oxo- 2,5- dihydropyridazin- 3- yl]- 2- fluorobenzamide
Smiles: Clc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1F)c1ccc(c(c1)C)C

STK587394
Synonyms: 7- (3- chlorobenzyl)- 10- methoxy- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1cccc(c1)Cl

STK587395
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (furan- 2- ylmethyl)- 5- (4- hydroxyphenyl)pyrrolidine- 2,3- dione
Smiles: Oc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1Cc1ccco1

STK587396
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (4- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)Nc1ccccc1C(C)(C)C

STK587398
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 7- chloro- 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)Nc2c1cccc2Cl)C

STK587399
Synonyms: 1- (4- fluorophenyl)- N- (3- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)F)CCCC3)c1ccc(cc1)C

STK587400
Synonyms: 1- (2,4- dichlorobenzyl)- 3,7- dimethyl- 8- (3- methylpiperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCCN(C1)c1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccc(cc1Cl)Cl

STK587401
Synonyms: 7- [(E)- (1,3- dihydro- 2H- benzimidazol- 2- ylidenehydrazinylidene)methyl][1,3]dioxolo[4,5- g]quinolin- 6(5H)- one
Smiles: O=c1[nH]c2cc3OCOc3cc2cc1/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK587402
Synonyms: 4- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl4- [(tert- butoxycarbonyl)amino]butanoate
Smiles: O=C(Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)CCCNC(=O)OC(C)(C)C

STK587403
Synonyms: 4- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK587404
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(E)- (4- chlorophenyl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Clc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1

STK587407
Synonyms: 7- bromo- 1- (2,3- dimethoxyphenyl)- 2- (4- methyl- 1,3- thiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1c(OC)cccc1C1N(c2scc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK587408
Synonyms: 9- (2,4- dimethoxyphenyl)- 2- (ethylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nc2n(n1)C(C1=C(O)CCCC1=N2)c1ccc(cc1OC)OC

STK587409
Synonyms: 1- (1,3- benzothiazol- 2- yl)- 5- phenyl- 1,2- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]n(c(n1)c1ccccc1)c1nc2c(s1)cccc2

STK587410
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,5- dichlorophenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1COc1ccc(cc1)Cl

STK587411
Synonyms: 5- (3- methoxyphenyl)- 4- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C

STK587412
Synonyms: 2- (3- chlorophenyl)- 5- (3- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1cccc(c1)C1Oc2ccccc2C2N1N=C(C2)c1cccc(c1)Cl

STK587413
Synonyms: methylN- [(4- fluorophenyl)carbamoyl]- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1)F)C

STK587414
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[5- (2- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1ccccc1OC

STK587415
Synonyms: N- [3- (dimethylamino)propyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CN(CCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2)C

STK587421
Synonyms: 1- benzyl4- (2- chloro- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)piperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OCc1ccccc1)Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3

STK587423
Synonyms: 7- chloro- 1- (3- chlorophenyl)- 2- (4- methylpyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1cccc(c1)C1N(c2nccc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK587425
Synonyms: 9- (4- methylphenyl)- 2- (prop- 2- en- 1- ylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: C=CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccc(cc1)C

STK587426
Synonyms: 2- {[7,7- dimethyl- 2- (3- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK587427
Synonyms: N- (2,4- dimethoxyphenyl)- 2- {[7,7- dimethyl- 2- (4- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK587428
Synonyms: 5- (3- chlorophenyl)- 4- ({(E)- [4- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(F)(F)F

STK587430
Synonyms: 4- {[(E)- (4- ethoxyphenyl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK587431
Synonyms: N- (2- bromo- 4- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Br)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK587432
Synonyms: 2- ethyl- 1- [(2E)- 2- (2- hydroxybenzylidene)hydrazinyl]- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1ccccc1O)c1ccccc1n2

STK587435
Synonyms: 4- (furan- 2- ylmethyl)- 3- [(3- methoxybenzyl)sulfanyl]- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)OC

STK587436
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(dimethylamino)methyl]- N'- [(1E)- 1- (furan- 2- yl)ethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccco1)\C)C

STK587439
Synonyms: (4E)- 1- hexadecyl- 4- [hydroxy(phenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1

STK587440
Synonyms: 9- (4- hydroxy- 3- methoxyphenyl)- 6- (2- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O

STK587441
Synonyms: (2E)- 3- (3,5- dichloro- 4- hydroxyphenyl)- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Cl)O)/c1scc(n1)c1cc2ccccc2oc1=O

STK587442
Synonyms: N- [(4,11- dimethyl- 2- oxo- 6,7,8,9- tetrahydro- 2H- [1]benzofuro[3,2- g]chromen- 3- yl)acetyl]norleucylglycine
Smiles: CCCCC(C(=O)NCC(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

STK587443
Synonyms: (5Z)- 5- {[(3- ethyl- 2',6'- dihydroxy- 4'- oxo- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 8- yl)amino]methylidene}- 6- hydroxy- 3- propylpyrimidine- 2,4(3H,5H)- dione
Smiles: CCCN1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)CC)C(=NC(=NC2=O)O)O)/C1=O)O

STK587445
Synonyms: 2- ({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK587448
Synonyms: methyl5- cyano- 6- ({2- [(2,6- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- ethoxyphenyl)- 2- hydroxy- 3,4- dihydropyridine- 3- carboxylate
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2c(C)cccc2C)N=C(C1C(=O)OC)O)C#N

STK587451
Synonyms: methyl4- [(E)- {[3- (2- fluorophenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]imino}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK587452
Synonyms: N- [(2Z)- 4- (4- chlorophenyl)- 1,3- thiazol- 2(3H)- ylidene]- 4- (2- oxo- 2H- chromen- 3- yl)benzamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)c2ccc(cc2)c2cc3ccccc3oc2=O)/[nH]1

STK587454
Synonyms: 2- (methylsulfanyl)- 9- (3- methylthiophen- 2- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1sccc1C

STK587455
Synonyms: (5Z)- 5- [(cyclopropylamino)methylidene]- 1- (2,4- dimethylphenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=NC(=O)/C(=C/NC2CC2)/C1=O)S

STK587456
Synonyms: 6- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- ylN- [(4- methylphenyl)sulfonyl]norvalinate
Smiles: CCCC(C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCC1)NS(=O)(=O)c1ccc(cc1)C

STK587457
Synonyms: 6- chloro- 3,4- dimethyl- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: Clc1cc2c(c3c1OCN(C3)Cc1ccncc1)oc(=O)c(c2C)C

STK587458
Synonyms: (6E)- 4- (1- benzofuran- 2- yl)- 6- [(4- methylphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc(cc1)/N=c/1\[nH]c(N)nc(n1)c1cc2c(o1)cccc2

STK587459
Synonyms: 4- (4- chlorophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Clc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK587461
Synonyms: 2- (4- chlorophenyl)- 8- methoxy- 3- phenyl- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)c1ccc(cc1)Cl)c1ccccc1

STK587462
Synonyms: N- [(2E)- 5,5- dioxido- 3- phenyltetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK587463
Synonyms: N- (1,3- dimethyl- 2,4,6- trioxo- 1,1',2',3,3',3a',4,6- octahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 7'- yl)propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK587466
Synonyms: N- (2- fluorophenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccccc1F

STK587467
Synonyms: N- (4- methylphenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK587468
Synonyms: (3E)- 3- (1,3- benzodioxol- 5- ylmethylidene)- 4- imino- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1ccc2c(c1)OCO2)cccc3

STK587470
Synonyms: 4- {[4- (2- fluorophenyl)piperazin- 1- ium- 1- yl]methyl}- 2- oxo- 7- phenyl- 2H- chromen- 6- olate
Smiles: O=c1cc(C[NH+]2CCN(CC2)c2ccccc2F)c2c(o1)cc(c(c2)[O-])c1ccccc1

STK587472
Synonyms: 3- (furan- 2- ylmethyl)- 2- propyl- 4H- thiochromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCCc1nc2sc3ccccc3c(=O)c2c(=O)n1Cc1ccco1

STK587473
Synonyms: N- {(1Z)- 1- [1- cyano- 2- oxo- 2- (phenylamino)ethylidene]- 1H- isoindol- 3- yl}- 3,4,5- trimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C(=O)Nc1ccccc1

STK587474
Synonyms: (3S,3a'S,8a'S,8b'R)- 5- chloro- 2'- (prop- 2- en- 1- yl)- 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: C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2

STK587475
Synonyms: 1- ethyl- 2',6'- dihydroxy- 2- methyl- 1,4- dihydro- 2H,4'H,5H- spiro[dipyrido[1,2- a:2',3'- d]pyrimidine- 3,5'- pyrimidine]- 4',5- dione
Smiles: CCN1c2nc3ccccn3c(=O)c2CC2(C1C)C(=NC(=NC2=O)O)O

STK587477
Synonyms: 4- {[(E)- (2- chlorophenyl)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/c1ccccc1Cl

STK587479
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- fluorophenyl)carbonyl]- 2'- (pyridin- 3- ylcarbonyl)- 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)c1cccnc1)C(=O)Nc1c2cccc1)cccc3

STK587481
Synonyms: 8- (2- {(Z)- [4- hydroxy- 1- (4- methoxyphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}hydrazinyl)- 1,3,7- trimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C/NNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)/C1=O)O

STK587482
Synonyms: 2- (pyridin- 4- yl)[1,2,4]triazolo[1,5- c]quinazoline- 5(6H)- thione
Smiles: S=c1[nH]c2ccccc2c2n1nc(n2)c1ccncc1

STK587483
Synonyms: 3- benzyl- 8- (4- ethoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STK587484
Synonyms: 4- chloro- N- [(2Z)- 6- methoxy- 3- [(3- methoxyphenyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: COc1cccc(c1)Nc1nc2cc(OC)ccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)Cl

STK587485
Synonyms: 6- (3- bromophenyl)- 2- methyl- 7- (pyridin- 3- yl)- 7,12- dihydro- 6H- chromeno[4,3- d][1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Brc1cccc(c1)C1Oc2ccc(cc2C2=C1C(c1cccnc1)n1ncnc1N2)C

STK587486
Synonyms: 2- {5- [(4- tert- butylbenzyl)sulfanyl]- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1ccccn1

STK587489
Synonyms: N- [2- (4- chlorophenyl)- 6- methyl- 5- oxo- 4- phenyl- 2,5- dihydropyridazin- 3- yl]- 2- fluorobenzamide
Smiles: Clc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccccc1F)c1ccccc1

STK587490
Synonyms: 6- benzyl- 1,3- dimethyl- 5- (3- nitrophenyl)- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: [O-][N+](=O)c1cccc(c1)c1n(Cc2ccccc2)cc2c1c(=O)n(c(=O)n2C)C

STK587491
Synonyms: (2E)- N- [5- (4- chlorophenyl)- 7- (4- fluorophenyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 3- (3- nitrophenyl)prop- 2- enamide
Smiles: O=C(Nc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)F)c1ccc(cc1)Cl)/C=C/c1cccc(c1)[N+](=O)[O-]

STK587492
Synonyms: (4E)- 5- (4- chlorophenyl)- 4- [hydroxy(4- methylphenyl)methylidene]- 1- (2- phenylethyl)pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1CCc1ccccc1

STK587493
Synonyms: 2- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 6,7- dimethoxy- 1- methyl- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CCN(C(c2cc1OC)C)S(=O)(=O)c1ccc2c(c1)OCCO2

STK587494
Synonyms: 2- {[4- amino- 5- (5- methyl- 1H- 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)c1n[nH]c(c1)C

STK587495
Synonyms: tert- butyl(3S)- 3- {[(2S)- 3- methyl- 1- oxo- 1- {[4- (propan- 2- yl)phenyl]amino}butan- 2- yl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: CC([C@@H](C(=O)Nc1ccc(cc1)C(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK587496
Synonyms: N- (3,4- dimethoxyphenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK587497
Synonyms: N- (3,4- dichlorophenyl)- 1- (4- ethylphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(c(c1)Cl)Cl)cc3c1ccc(cc1)C

STK587499
Synonyms: 7- chloro- 2- methyl- 1- (thiophen- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccs1)C

STK587500
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1)C

STK587501
Synonyms: (2S)- N- (3,5- dichlorophenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)Nc1cc(Cl)cc(c1)Cl

STK587502
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,6- dimethylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1c(C)cccc1C

STK587503
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (4- methoxyphenyl)ethylidene]- 5- {[methyl(phenyl)amino]methyl}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)/C

STK587504
Synonyms: 4- {[(2S)- 2- {[3- (3- tert- butyl- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]amino}- 2- phenylacetyl]amino}butanoicacid
Smiles: O=C(N[C@@H](c1ccccc1)C(=O)NCCCC(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C

STK587505
Synonyms: 4- (3,5- dihydroxy- 7,7- dimethyl- 2- phenyl- 4,6,7,8- tetrahydro- 2H- pyrazolo[3,4- b]quinolin- 4- yl)- 2- methoxyphenylacetate
Smiles: COc1cc(ccc1OC(=O)C)C1C2=C(O)CC(CC2=Nc2c1c(O)n(n2)c1ccccc1)(C)C

STK587509
Synonyms: N- (4- bromophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nnc1c1ccccn1

STK587510
Synonyms: 4- butyl- 6- chloro- 2- oxo- 2H- chromen- 7- ylN- [(4- methylphenyl)sulfonyl]- L- valinate
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)[C@H](C(C)C)NS(=O)(=O)c1ccc(cc1)C

STK587511
Synonyms: (1'S,2'S,3R,3a'R)- 7'- methyl- 1',2'- bis(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)c2ccccc2)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1

STK587512
Synonyms: 1- (4- ethoxyphenyl)- 7- fluoro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK587513
Synonyms: 8- (4- chlorophenyl)- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Clc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK587514
Synonyms: (4E)- 4- {[(3- methoxyphenyl)amino]methylidene}- 2- (6- methylpyridin- 2- yl)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1cccc(c1)N/C=C\1/C(=O)N(c2cccc(n2)C)C(=O)c2c1cccc2

STK587515
Synonyms: 1- (4- chlorophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1c1ccccn1

STK587517
Synonyms: (2E,5Z)- 2- [(3- chlorophenyl)imino]- 5- (2,3- dimethoxybenzylidene)- 1,3- thiazolidin- 4- one
Smiles: COc1c(cccc1OC)/C=C/1\S/C(=N/c2cccc(c2)Cl)/NC1=O

STK587518
Synonyms: 4- (5- {(Z)- [1- (2- fluorobenzyl)- 2- hydroxy- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}furan- 2- yl)- 3- methylbenzoicacid
Smiles: OC1=N/C(=C\c2ccc(o2)c2ccc(cc2C)C(=O)O)/C(=O)N1Cc1ccccc1F

STK587519
Synonyms: methylN- [(3- acetylphenyl)carbamoyl]- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1cccc(c1)C(=O)C

STK587520
Synonyms: N- benzyl- 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: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccccc1

STK587521
Synonyms: 2- (4- methoxyphenyl)- 12- phenyl- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccccc2)C2=C(O1)CCCC2=O

STK587523
Synonyms: 3- [(4- chloro- 2- fluorobenzyl)oxy]- 1- hydroxy- 9H- xanthen- 9- one
Smiles: Clc1ccc(c(c1)F)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1

STK587524
Synonyms: N- (butan- 2- ylcarbamoyl)- D- methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)NC(CC)C

STK587527
Synonyms: 2,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK587528
Synonyms: N- (3,5- dichlorophenyl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK587529
Synonyms: 1- (3,5- dimethoxyphenyl)- 2- phenyl- 5,6,7,8- tetrahydroquinazoline- 4(1H)- thione
Smiles: COc1cc(OC)cc(c1)n1c(nc(=S)c2c1CCCC2)c1ccccc1

STK587531
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- [(diethylammonio)methyl]- 4- oxo- 4H- chromen- 7- olate
Smiles: CC[NH+](Cc1c([O-])ccc2c1occ(c2=O)c1nc2c(s1)cccc2)CC

STK587532
Synonyms: 3- (3- chlorophenyl)- 4- (4- chlorophenyl)- 5- [(3- methoxybenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK587533
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- chlorophenyl)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)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK587534
Synonyms: (5- chloro- 2- hydroxyphenyl)[1- (3,4- dichlorophenyl)- 3- methyl- 1H- pyrazolo[3,4- b]pyridin- 5- yl]methanone
Smiles: Clc1ccc(c(c1)C(=O)c1cnc2c(c1)c(C)nn2c1ccc(c(c1)Cl)Cl)O

STK587535
Synonyms: methyl(8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)acetate
Smiles: COC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK587537
Synonyms: 8- (4- butylphenyl)- 3- ethyl- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCCCc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC

STK587538
Synonyms: 4- (2- methoxyphenyl)- 1- [4- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1ccccc1C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)C(F)(F)F

STK587539
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 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)nnc1COc1ccc(cc1)C

STK587540
Synonyms: 10- (3,4- dihydroxyphenyl)- 1,3- dimethyl- 5- (4- methylphenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Cc1ccc(cc1)c1c2c(c3n1CCOC3c1ccc(c(c1)O)O)n(C)c(=O)n(c2=O)C

STK587541
Synonyms: 5- (4- ethoxyphenyl)- 4- {[(E)- (2,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(OC)c(cc1OC)OC

STK587542
Synonyms: 5- {(Z)- [3- (2- chlorobenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 6- [4- (2- hydroxyethyl)piperazin- 1- yl]- 1,4- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: OCCN1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)Cc2ccccc2Cl)c(C)c(c(=O)n1C)C#N

STK587543
Synonyms: 9- (4- ethylphenyl)- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCc1ccc(cc1)C1C2=C(O)CCCC2=Nc2n1nc(n2)SC

STK587544
Synonyms: 4- [({[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccccc1)c1cnccn1

STK587545
Synonyms: (4E)- 1- (5- acetyl- 4- methyl- 1,3- thiazol- 2- yl)- 5- [4- (benzyloxy)- 3- ethoxyphenyl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK587547
Synonyms: (5Z)- 3- (2- chlorophenyl)- 6- hydroxy- 5- [(2E)- 1- hydroxy- 3- (4- hydroxy- 3- methoxyphenyl)prop- 2- en- 1- ylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(/C=C/C(=C/2\C(=NC(=O)N(C2=O)c2ccccc2Cl)O)/O)ccc1O

STK587548
Synonyms: N- butyl- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: CCCCNC(=S)N1CCc2c(C1)cc(c(c2)OC)OC

STK587549
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (1,3- benzodioxol- 5- ylcarbonyl)- 2'- [(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]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK587553
Synonyms: (1Z)- 3- (2,4- dichlorophenoxy)- 1- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)butan- 2- one
Smiles: O=C(C(Oc1ccc(cc1Cl)Cl)C)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK587554
Synonyms: (5Z)- 2,6- dihydroxy- 5- {[1- (2- hydroxyphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C\c2cc(n(c2C)c2ccccc2O)C)/C(=N1)O

STK587555
Synonyms: N- [(2Z)- 6- chloro- 4- phenylquinazolin- 2(1H)- ylidene]- 5- (3- methoxypropyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: COCCCN1CNC(=NC1)/N=c/1\nc(c2ccccc2)c2c([nH]1)ccc(c2)Cl

STK587557
Synonyms: 2- [(4Z)- 4- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 3- oxo- 1- phenylbutan- 2- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cc2/C(=C/C(=O)C(N3C(=O)c4c(C3=O)cccc4)Cc3ccccc3)/NCCc2cc1OC

STK587558
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK587559
Synonyms: 6- hydroxy- 7- (2- hydroxy- 2- phenylethyl)- 3- methyl- 8- [(2E)- 2- (pyridin- 3- ylmethylidene)hydrazinyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(c1ccccc1)Cn1c(N/N=C/c2cccnc2)nc2c1c(O)nc(=O)n2C

STK587560
Synonyms: (2,6,8- trioxo- 10- phenyl- 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(C2c2ccccc2)sc(=O)[nH]1

STK587561
Synonyms: 4- hydroxy- 2- (methylsulfanyl)- 5- (2,3,4- trimethoxyphenyl)- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1ccc(c(c1OC)OC)OC

STK587562
Synonyms: 2- {[5- (2- fluorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK587563
Synonyms: (3a'S,6a'R)- 3',6,7- trimethyl- 5'- (2- phenylethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2ccc(c1C)C

STK587564
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 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)Cc1cccs1

STK587565
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)(3- methylphenyl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1cccc(c1)C

STK587566
Synonyms: 8- ethyl- N- (2- phenylethyl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: CCN1CCc2c(C1)sc1c2c(NCCc2ccccc2)nc2n1nnn2

STK587567
Synonyms: 2- {[4- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanoyl]amino}benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)CCCn1nnc2c(c1=O)cccc2

STK587568
Synonyms: 3- [3- (4- fluorophenyl)- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]- N- (3- methoxypropyl)propanamide
Smiles: COCCCNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F

STK587569
Synonyms: (3'E)- 3'- [hydroxy(4- propoxyphenyl)methylidene]- 1'- (3- methoxypropyl)- 1- (prop- 2- en- 1- yl)spiro[indole- 3,2'- pyrrolidine]- 2,4',5'(1H)- trione
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C21C(=O)N(c1c2cccc1)CC=C)CCCOC)/O

STK587573
Synonyms: (3a'S,6a'R)- 5- fluoro- 3'- (4- hydroxybenzyl)- 5'- (3- 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: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C)Cc1ccc(cc1)O)C(=O)N2

STK587574
Synonyms: 2- (4- methoxyphenyl)- 3- phenyl- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc(cc1)c1nc2oc3ccccc3c(=O)c2c(=O)n1c1ccccc1

STK587575
Synonyms: (4E)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}- 2- (2,4,6- trimethylphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK587576
Synonyms: N- (3,4- dimethylphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C)C)nnc1c1cccc(c1)C

STK587579
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- N- cyclohexylpyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2NC1CCCCC1)C(C)(C)C

STK587580
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 8- [(3- hydroxypropyl)amino]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCCNc1nc2c(n1CC(COc1cccc(c1)C)O)c(O)nc(=O)n2C

STK587581
Synonyms: 1- (3- methoxy- 4- propoxyphenyl)- 2- [2- (morpholin- 4- yl)ethyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCCOc1ccc(cc1OC)C1N(CCN2CCOCC2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK587583
Synonyms: 1,7- dimethyl- 3- [(2E)- 3- phenylprop- 2- en- 1- yl]- 8- (tetrahydrofuran- 2- ylmethyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cn1c(=O)n(C/C=C/c2ccccc2)c(=O)c2c1nc1n2cc(n1CC1CCCO1)C

STK587585
Synonyms: N- [(3Z)- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2- nitrobenzenesulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1ccccc1c2)C

STK587586
Synonyms: 3- [(2E)- 2- {[5- (2- methoxy- 4- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]- 5H- [1,2,4]triazino[5,6- b]indole
Smiles: COc1cc(ccc1c1ccc(o1)/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1)[N+](=O)[O-]

STK587588
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)Nc1ccc2c(c1)OCCO2

STK587589
Synonyms: N- (butan- 2- yl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- amine
Smiles: CCC(Nc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)C

STK587590
Synonyms: N- (2- bromophenyl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1C)c1cccc(c1)Cl

STK587592
Synonyms: N- (butan- 2- ylcarbamoyl)- L- phenylalanine
Smiles: CCC(NC(=O)N[C@H](C(=O)O)Cc1ccccc1)C

STK587593
Synonyms: 5- (2,4- dichlorophenyl)- 4- {[(1E,2E)- 3- (furan- 2- yl)- 2- methylprop- 2- en- 1- ylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: C/C(=C\c1ccco1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1Cl)Cl

STK587595
Synonyms: 7- bromo- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (3- propoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK587596
Synonyms: (4Z)- 4- ({[2- (4- methoxyphenyl)ethyl]amino}methylidene)- 2- phenylisoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1)CCN/C=C/1\C(=O)N(c2ccccc2)C(=O)c2c1cccc2

STK587597
Synonyms: (5Z)- 5- {[1- (5- chloro- 2- methylphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 1- (prop- 2- en- 1- yl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: C=CCN1C(=NC(=O)/C(=C/c2cc(n(c2C)c2cc(Cl)ccc2C)C)/C1=O)S

STK587598
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STK587599
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 5- [3- (prop- 2- en- 1- yloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK587600
Synonyms: (2Z)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2- (pyridin- 3- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK587601
Synonyms: 3- hexyl- 11- {[(E)- thiophen- 2- ylmethylidene]amino}- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cccs1

STK587602
Synonyms: 6'- chloro- 1,3- bis(4- methylphenyl)- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: Cc1ccc(cc1)N1C(=O)N(c2ccc(cc2)C)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CCC1

STK587604
Synonyms: (2S)- N- benzyl- 2- (1- methyl- 2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)- 3- phenylpropanamide
Smiles: O=c1n([C@H](C(=O)NCc2ccccc2)Cc2ccccc2)c(=O)c2c(n1C)cccc2

STK587605
Synonyms: (5Z)- 5- {1- [(3,5- dimethoxybenzyl)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)/NCc1cc(OC)cc(c1)OC

STK587606
Synonyms: 4- methyl- 9- (2- phenylpropyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: O=c1cc(C)c2c(o1)c1CN(COc1cc2)CC(c1ccccc1)C

STK587610
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: O=C1N(c2nc3c(s2)cccc3)C(c2c1oc1ccccc1c2=O)c1ccccc1

STK587611
Synonyms: (5- fluoro- 1H- indol- 2- yl)[4- (3- methoxyphenyl)piperazin- 1- yl]methanone
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)F

STK587614
Synonyms: 7- chloro- 1- hydroxy- 3- [(4- nitrobenzyl)oxy]- 9H- xanthen- 9- one
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)cc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK587615
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- dimethylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)C)nnc1COc1ccc(cc1)C

STK587617
Synonyms: 5- (3,4- dichlorophenyl)- N'- [(E)- pyridin- 3- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)N/N=C/c1cccnc1

STK587618
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethyl- 6- methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl)C

STK587620
Synonyms: 2- hydroxy- 5- oxo- 7- phenyl- N- [4- (propan- 2- yl)phenyl]- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(cc1)C(C)C)C(=O)CC(C2)c1ccccc1

STK587621
Synonyms: N'- [(E)- {4,6- dioxo- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]- 1,6- dihydropyrimidin- 5(4H)- ylidene}methyl]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)NN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S

STK587622
Synonyms: 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl[(tert- butoxycarbonyl)amino](phenyl)acetate
Smiles: O=C(OC(C)(C)C)NC(c1ccccc1)C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCC1

STK587624
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1)CC

STK587626
Synonyms: 3- (1H- benzimidazol- 2- yl)- 1- [3- (dimethylamino)propyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: CN(CCCn1c2nc3ccccc3nc2c(c1N)c1nc2c([nH]1)cccc2)C

STK587627
Synonyms: ethyl6'- amino- 5- fluoro- 3'- methyl- 2- oxo- 1'- phenyl- 1,2- dihydro- 1'H- spiro[indole- 3,4'- pyrano[2,3- c]pyrazole]- 5'- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C31C(=O)Nc1c3cc(F)cc1)c(C)nn2c1ccccc1

STK587628
Synonyms: 1- (2,4- dichlorophenyl)- 3- [N'- (4,6- dimethylpyrimidin- 2- yl)- N- (4- methoxyphenyl)carbamimidoyl]urea
Smiles: COc1ccc(cc1)N/C(=N/c1nc(C)cc(n1)C)/NC(=O)Nc1ccc(cc1Cl)Cl

STK587629
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK587632
Synonyms: N- [3,5- bis(trifluoromethyl)phenyl]- 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK587633
Synonyms: (5E)- 3- benzyl- 5- {[2,5- dimethyl- 1- (4- methylphenyl)- 1H- pyrrol- 3- yl]methylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O

STK587634
Synonyms: 8- (4- ethoxyphenyl)- 3- (2- fluorobenzyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STK587635
Synonyms: 2- [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- 1- ol
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccc2c(c1O)cccc2)c1ccccc1

STK587637
Synonyms: 6- (4- methoxybenzyl)- 1- (2- phenylethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)nc(n2CCc1ccccc1)S

STK587638
Synonyms: methyl[1- (7- methyl- 3- {(Z)- [3- (3- methylbutyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 2- yl)- 3- oxopiperazin- 2- yl]acetate
Smiles: COC(=O)CC1C(=O)NCCN1c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCC(C)C)C

STK587640
Synonyms: 4- (3,4- dichlorophenyl)- N- (3- methylphenyl)- 1- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)C)n2c3c1CCCCn3c(c2)c1ccc(c(c1)Cl)Cl

STK587641
Synonyms: 5- tert- butyl- 3- (4- chlorophenyl)- 2- methyl- 7- (pentylsulfanyl)pyrazolo[1,5- a]pyrimidine
Smiles: CCCCCSc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK587642
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl)CC

STK587643
Synonyms: (1Z,2E)- 1- {2- (3- fluorophenyl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}- 3- phenylprop- 2- en- 1- olate
Smiles: Fc1cccc(c1)C1/C(=C(\C=C\c2ccccc2)/[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK587644
Synonyms: 6- cyclohexyl- 1- (2- phenylethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCCC1)CCc1ccccc1

STK587646
Synonyms: 1- (4- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK587647
Synonyms: N- (2- ethyl- 6- methylphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccccc1)c1nccnc1)C

STK587648
Synonyms: (1'R,2'S)- 1'- [(4- chlorophenyl)carbonyl]- 2'- (2- fluorophenyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1F)C(=O)c1c(C2=O)cccc1

STK587651
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1Cc1cccs1

STK587654
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (3- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK587656
Synonyms: 4- hydroxy- 1,6,7- trimethyl- 8- (tetrahydrofuran- 2- ylmethyl)- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1c(n2)n(c(c1C)C)CC1CCCO1)C

STK587657
Synonyms: N- [(2E)- 3- (2- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- phenylpropanamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1Cl)CS(=O)(=O)C2)CCc1ccccc1

STK587658
Synonyms: (6E)- 6- [(3,5- dichlorophenyl)imino]- 4- (3- methyl- 1- benzofuran- 2- yl)- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Clc1cc(Cl)cc(c1)/N=c/1\[nH]c(N)nc(n1)c1oc2c(c1C)cccc2

STK587659
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2,4- dimethoxyphenyl)carbonyl]- 3'- [(4- fluorophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK587660
Synonyms: N- (3,4- difluorophenyl)- 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)F)F)nnc1c1ccccn1

STK587661
Synonyms: 1- (4- ethoxyphenyl)- 4- (4- methoxyphenyl)- N- (3- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)C)cc3c1ccc(cc1)OC

STK587662
Synonyms: N- (2,5- dimethoxyphenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1cc(OC)ccc1OC

STK587663
Synonyms: 1,4- bis(4- chlorophenyl)- N- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(cc1)Cl

STK587664
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK587666
Synonyms: 3- (4- 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)Cc1ccc(cc1)F

STK587667
Synonyms: 2- [5- hydroxy- 2- (2- phenylethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: Oc1cc(N2C(=O)c3c(C2=O)cccc3)n2c(n1)nc(n2)CCc1ccccc1

STK587668
Synonyms: N- (3- bromophenyl)- 2- ({4- ethyl- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)Br)nnc1COc1ccc(cc1)C

STK587669
Synonyms: (3a'S,6a'R)- 5'- (4- fluorobenzyl)- 6,7- dimethyl- 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)Nc2c1ccc(c2C)C

STK587670
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (4- nitrophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)[N+](=O)[O-]

STK587672
Synonyms: 2- (4- methoxyphenyl)- 3- {2- [2- (3- phenoxyphenoxy)ethoxy]ethyl}quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1cccc(c1)Oc1ccccc1

STK587673
Synonyms: 2- chloro- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzamide
Smiles: Clc1ccccc1C(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)CC1CCCO1

STK587674
Synonyms: (4Z)- 5- hydroxy- 4- (4- hydroxy- 3- nitrobenzylidene)- 2- (4- iodophenyl)- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: Ic1ccc(cc1)N1N=C(/C(=C/c2ccc(c(c2)[N+](=O)[O-])O)/C1=O)O

STK587675
Synonyms: N- (3,4- dimethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK587676
Synonyms: 2- {[(6- chloro- 1,3- benzodioxol- 5- yl)methyl]sulfanyl}- 5- hydroxy- 4- (4- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(SCc2cc3OCOc3cc2Cl)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)OC