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

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STK546463
Synonyms: 3- butyl- 2- (butylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546464
Synonyms: 2- amino- N- butyl- 1- (4- chloro- 3- nitrophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl

STK546467
Synonyms: methyl3- amino- 4- (thiophen- 2- yl)- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]thieno[3,2- e]pyridine- 2- carboxylate
Smiles: COC(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCCC1

STK546469
Synonyms: butyl2- amino- 1- (4- butylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)CCCC

STK546471
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chloro- 6- fluorobenzyl)oxy]- 3- ethoxyphenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK546472
Synonyms: 2- (diethylamino)- 3- [(Z)- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN(c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)CC

STK546473
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [4- (2,4- dichlorobenzyl)piperazin- 1- yl]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CN1CCN(CC1)Cc1ccc(cc1Cl)Cl

STK546475
Synonyms: 3- amino- 6- ethyl- N- (2- methoxybenzyl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccccc1OC

STK546476
Synonyms: 3- (4- methoxyphenyl)- 10- (3- methylbutanoyl)- 11- (3,4,5- trimethoxyphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C)C

STK546477
Synonyms: ethyl3- {[(8- methoxy- 2- methyl- 4- oxoquinolin- 1(4H)- yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)Cn1c(C)cc(=O)c2c1c(OC)ccc2

STK546478
Synonyms: 3- {[(5E)- 5- (4- ethoxybenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]methyl}benzoicacid
Smiles: CCOc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)Cc1cccc(c1)C(=O)O

STK546479
Synonyms: N'- {(E)- [1- (4- bromophenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br

STK546480
Synonyms: (3S)- 2- (2- methoxyphenyl)- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)cyclopropane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](C1c1ccccc1OC)C(=O)C12CC3CC(C2)CC(C1)C3

STK546481
Synonyms: N- (2,5- dimethylphenyl)- 10- methyl- 8- phenyl- 11- [4- (propan- 2- yl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)C)c(nn1c1ccccc1)C)C

STK546482
Synonyms: ethyl2- ({[(3- cyano- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl)sulfanyl]acetyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCCc3cc2C#N)sc2c1CCCC2

STK546483
Synonyms: 11- (3- chlorophenyl)- N- (3,5- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cc(C)cc(c1)C)c1ccccc1

STK546484
Synonyms: 3- [2- (2,6- dimethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)cccc1C

STK546485
Synonyms: 2- chloro- N- {[2- (naphthalen- 1- yl)- 1,3- benzoxazol- 5- yl]carbamothioyl}benzamide
Smiles: S=C(NC(=O)c1ccccc1Cl)Nc1ccc2c(c1)nc(o2)c1cccc2c1cccc2

STK546486
Synonyms: 2- (hexylsulfanyl)- 6- iodo- 3- (2- methylphenyl)quinazolin- 4(3H)- one
Smiles: CCCCCCSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK546487
Synonyms: 2- amino- 1- (3- chloro- 4- methoxyphenyl)- N- cyclohexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CCCCC1

STK546488
Synonyms: ethyl4- cyano- 5- ({[(3- cyano- 4- phenyl- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl)sulfanyl]acetyl}amino)- 3- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc2CCCc2c(c1C#N)c1ccccc1

STK546490
Synonyms: prop- 2- en- 1- yl2- amino- 1- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

STK546491
Synonyms: N- benzyl- 4- [(2E)- 2- (4- butoxybenzylidene)hydrazinyl]- 6- methylpyrimidin- 2- amine
Smiles: CCCCOc1ccc(cc1)/C=N/Nc1cc(C)nc(n1)NCc1ccccc1

STK546495
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (4- phenylpiperazin- 1- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccccc1)c(n2Cc1ccccc1)C

STK546497
Synonyms: 2- methoxyethyl2- amino- 1- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)CCc1ccc(c(c1)OC)OC

STK546498
Synonyms: 5- [(4- ethoxyphenyl)amino]- 3- (4- nitrobenzyl)- 1,3- thiazolidine- 2,4- dione
Smiles: CCOc1ccc(cc1)NC1SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]

STK546499
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- ethoxy- 4- [(2- fluorobenzyl)oxy]phenyl}methylidene]- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN(CC)CC)c2nonc2N)cc(c1OCc1ccccc1F)Br

STK546500
Synonyms: 1H- benzotriazol- 1- yl[(1R,2S,3S,3aS)- 2- (4- methoxyphenyl)- 3- nitro- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinolin- 1- yl]methanone
Smiles: COc1ccc(cc1)[C@@H]1[C@H]([N+](=O)[O-])[C@H]2N([C@H]1C(=O)n1nnc3c1cccc3)c1ccccc1C=C2

STK546501
Synonyms: (8S,8aR,11aS)- 8- [(3- nitrophenyl)carbonyl]- 10- [2- (trifluoromethyl)phenyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3)c1cccc(c1)[N+](=O)[O-]

STK546503
Synonyms: 2- methoxyethyl2- amino- 1- (4- chlorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)Cl

STK546504
Synonyms: 2,4- dichloro- N- [(9,10- dioxo- 9,10- dihydroanthracen- 2- yl)carbamothioyl]benzamide
Smiles: S=C(NC(=O)c1ccc(cc1Cl)Cl)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1

STK546505
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- {(E)- [4- (2,4- dinitrophenoxy)- 3- ethoxyphenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCc3c2cccc3)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK546506
Synonyms: ethyl4- ({[4- (1,3- thiazol- 2- ylsulfamoyl)phenyl]carbamothioyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK546509
Synonyms: methyl4- (10- hexanoyl- 1- oxo- 3- phenyl- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 11- yl)benzoate
Smiles: CCCCCC(=O)N1C(c2ccc(cc2)C(=O)OC)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccccc1

STK546510
Synonyms: (3S)- 2- (3- bromo- 4- methoxyphenyl)- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)cyclopropane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)C([C@@H]1C(=O)C12CC3CC(C2)CC(C1)C3)c1ccc(c(c1)Br)OC

STK546511
Synonyms: 5- (3,4- dimethoxyphenyl)- 3- hydroxy- 1- (4- hydroxyphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1OC)C1N(c2ccc(cc2)O)C(=O)C(=C1C(=O)c1ccccc1)O

STK546512
Synonyms: butylcyano[3- (4- methylpiperidin- 1- yl)quinoxalin- 2- yl]acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C)C#N

STK546513
Synonyms: 3- chloro- 1- (2- ethylphenyl)- 4- [(4- fluorophenyl)amino]- 1H- pyrrole- 2,5- dione
Smiles: CCc1ccccc1N1C(=O)C(=C(C1=O)Cl)Nc1ccc(cc1)F

STK546515
Synonyms: (8S,8aR)- 6- amino- 8- (4- chlorophenyl)- 2- (2- phenylethyl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)CCc1ccccc1)c1ccc(cc1)Cl)(C#N)C#N

STK546516
Synonyms: N,N- diethyl- 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)CC

STK546517
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3- chloro- 4- fluorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nc(c(c1c1cccs1)C#N)N

STK546518
Synonyms: [(4- chlorophenyl)sulfonyl][3- (morpholin- 4- yl)quinoxalin- 2- yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCOCC1

STK546519
Synonyms: 2- acetyl- N- (3,4- dimethyl- 2- thioxo- 2,3- dihydro- 1,3- thiazol- 5- yl)hydrazinecarboxamide
Smiles: O=C(Nc1sc(=S)n(c1C)C)NNC(=O)C

STK546520
Synonyms: 2- {[2- (dimethylamino)ethyl]sulfanyl}- 5- heptyl- 6- hydroxypyrimidin- 4(3H)- one
Smiles: CCCCCCCc1c(O)nc([nH]c1=O)SCCN(C)C

STK546521
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- methoxy- 3- [(2,4,6- trichlorophenoxy)methyl]phenyl}methylidene]- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1COc1c(Cl)cc(cc1Cl)Cl)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK546522
Synonyms: 2- (4- methoxyphenyl)- 3- {2- [2- (propan- 2- yloxy)phenoxy]ethyl}quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1OC(C)C

STK546523
Synonyms: N- [(2E)- 3,4- dihydroquinolin- 2(1H)- ylidene]- 1- phenylmethanamine
Smiles: c1ccc(cc1)C/N=C/1\CCc2c(N1)cccc2

STK546525
Synonyms: 1- hexadecyl- 3- hydroxy- 5- (4- methoxyphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=C(C1c1ccc(cc1)OC)C(=O)c1ccccc1)O

STK546526
Synonyms: butyl{3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}(cyano)acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N

STK546527
Synonyms: 4- (pyrrolidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: C1CCN(C1)c1ncnc2c1[nH]c1c2cccc1

STK546528
Synonyms: 2- (4- methoxyphenyl)- 3- {2- [5- methyl- 2- (propan- 2- yl)phenoxy]ethyl}quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)ccc1C(C)C

STK546530
Synonyms: 4- acetyl- 1- benzyl- 5- (3,4- dimethoxyphenyl)- 3- hydroxy- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1OC)C1N(Cc2ccccc2)C(=O)C(=C1C(=O)C)O

STK546532
Synonyms: 2- butyl- 3- methyl- 1- [4- (6- methylpyridin- 2- yl)piperazin- 1- yl]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1cccc(n1)C)c1ccccc1n2

STK546533
Synonyms: 5- hexyl- 6- hydroxy- 2- {[2- (morpholin- 4- yl)ethyl]sulfanyl}- 3- phenylpyrimidin- 4(3H)- one
Smiles: CCCCCCc1c(O)nc(n(c1=O)c1ccccc1)SCCN1CCOCC1

STK546535
Synonyms: methyl4- {6- [(2,4- dimethylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1C)C)nc1c2cccc1

STK546536
Synonyms: 3- amino- 6- ethyl- N- [4- (trifluoromethyl)phenyl]- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1ccc(cc1)C(F)(F)F

STK546537
Synonyms: ethyl4,5- dimethyl- 2- ({[(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]carbamothioyl}amino)thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2ccccc2)sc(c1C)C

STK546538
Synonyms: 4- hydroxy- N'- [(E)- (2- hydroxyphenyl)methylidene]- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)benzohydrazide
Smiles: O=C(c1ccc(c(c1)C12CC3CC(C2)CC(C1)C3)O)N/N=C/c1ccccc1O

STK546539
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(s1)SCc1ccccc1

STK546541
Synonyms: [(4- bromophenyl)sulfonyl]{3- [1- (3- methylbutyl)- 1H- imidazol- 3- ium- 3- yl]- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl}azanide
Smiles: CC(CCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2)C

STK546543
Synonyms: 2,6- dimethylphenyldiphenylacetate
Smiles: O=C(C(c1ccccc1)c1ccccc1)Oc1c(C)cccc1C

STK546544
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- [(3- cyano- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1cc2CCCCCc2nc1SCC(=O)Nc1sc2c(c1C#N)CCC2

STK546545
Synonyms: N,N- dibutyl- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)CCCC

STK546546
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- methoxyphenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1CSc1nc2c(s1)cccc2)/C=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N

STK546547
Synonyms: 2- [(3- chlorobenzyl)sulfanyl]- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridine- 3- carbonitrile
Smiles: N#Cc1cc2CCCCCc2nc1SCc1cccc(c1)Cl

STK546548
Synonyms: (2E)- N- ({4- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)sulfamoyl]phenyl}carbamothioyl)- 3- (4- methylphenyl)prop- 2- enamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C

STK546549
Synonyms: 2- (morpholin- 4- yl)- 6- phenylpyrimidine- 4- carboxamide
Smiles: NC(=O)c1nc(nc(c1)c1ccccc1)N1CCOCC1

STK546550
Synonyms: prop- 2- en- 1- yl2,3- dimethyl- 4- oxo- 4,5- dihydrothieno[3'',2'':5',6']pyrimido[1',2':1,5]pyrrolo[2,3- b]quinoxaline- 6- carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1c2sc(c1C)C

STK546551
Synonyms: 5- (4- {[4- methoxy- 3- (piperidin- 1- ylcarbonyl)phenyl]amino}phthalazin- 1- yl)- 2- methylbenzenesulfonamide
Smiles: COc1ccc(cc1C(=O)N1CCCCC1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N)C

STK546552
Synonyms: ethyl2- [(3- {[(4- fluorophenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)F)sc2c1CCC(C2)C

STK546553
Synonyms: 3''- amino- 8'',8a''- dihydrotrispiro[1,3- dioxolane- 2,1'- cyclohexane- 4',1''- naphthalene- 7'',2'''- [1,3]dioxolane]- 2'',2'',4''(6''H)- tricarbonitrile
Smiles: N#CC1=C(N)C(C2(C3C1=CCC1(C3)OCCO1)CCC1(CC2)OCCO1)(C#N)C#N

STK546554
Synonyms: 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (3- methylphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546555
Synonyms: 1- benzyl- 2- imino- N- (2- methoxyethyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1C

STK546557
Synonyms: 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: CCCn1c(SCC(=O)Nc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546558
Synonyms: ethyl2- amino- 5- cyano- 6- [(3,4- dichlorobenzyl)sulfanyl]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1cc(C#N)c(nc1N)SCc1ccc(c(c1)Cl)Cl

STK546560
Synonyms: N- (2- {[3- (3,6- dichloro- 9H- carbazol- 9- yl)- 2- hydroxypropyl][(4- methylphenyl)sulfonyl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccccc1N(S(=O)(=O)c1ccc(cc1)C)CC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK546562
Synonyms: 4- (phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)- 8- (4- chlorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1)Cl)Oc1ccc(cc1)C(=O)c1ccccc1

STK546563
Synonyms: 8- {[cyclohexyl(methyl)amino]methyl}- 7- hydroxy- 3- (3- methylphenoxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(C1CCCCC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1cccc(c1)C)C(F)(F)F

STK546565
Synonyms: 2- [(2- benzyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N,N- dibutylacetamide
Smiles: CCCCN(C(=O)CSc1nc(Cc2ccccc2)nc2c1c1CC(C)(C)OCc1s2)CCCC

STK546566
Synonyms: 1- (4- chlorophenyl)- 2- [(5- ethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]ethanone
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Cl)nn2)CCCC3

STK546567
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- [(3- cyano- 4- phenyl- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc2c(c1c1ccccc1)CCC2

STK546568
Synonyms: 2- amino- 6- [(3- fluorobenzyl)sulfanyl]- 4- (thiophen- 2- yl)pyridine- 3,5- dicarbonitrile
Smiles: N#Cc1c(SCc2cccc(c2)F)nc(c(c1c1cccs1)C#N)N

STK546569
Synonyms: methyl(1R,2R,3R,3aS)- 3- cyano- 2- (furan- 2- yl)- 1- (phenylcarbonyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccco2)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK546571
Synonyms: 2- [(3,7- dibenzyl- 4- oxo- 3,4,5,6,7,8- hexahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)Cc1ccccc1

STK546572
Synonyms: N- (2,5- dimethylphenyl)- 10- methyl- 11- (3- nitrophenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1)C

STK546573
Synonyms: 2- [(4- methylbenzyl)sulfanyl]- 3- (4- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCC3

STK546575
Synonyms: (1'R,2'R)- 1'- [(4- chlorophenyl)carbonyl]- 2'- phenyl- 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]1c1ccccc1)C(=O)c1c(C2=O)cccc1

STK546576
Synonyms: 3- {3- [4- (butan- 2- yl)phenoxy]propyl}- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCC(c1ccc(cc1)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC)C

STK546577
Synonyms: (5E)- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 2- (4- phenylpiperazin- 1- yl)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccccc1

STK546578
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(2E)- butan- 2- ylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC/C(=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N)/C

STK546579
Synonyms: 4- [(1E)- 1- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)ethyl]- 2- methoxyphenyl4- chlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C(=N/NC(=O)c1nnn(c1C)c1nonc1N)/C

STK546580
Synonyms: [(4- methylphenyl)sulfonyl][3- (4- phenylpiperazin- 1- yl)quinoxalin- 2- yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)c1ccccc1

STK546581
Synonyms: 6- amino- 4- (2- chloroquinolin- 3- yl)- 3- phenyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3ccccc3nc1Cl)c([nH]n2)c1ccccc1

STK546582
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546583
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (2- chlorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2Cl)nc(c(c1c1cccs1)C#N)N

STK546584
Synonyms: {[4- (acetylamino)phenyl]sulfonyl}(3- {4- [(thiophen- 2- ylcarbonyl)amino]pyridinium- 1- yl}quinoxalin- 2- yl)azanide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1cccs1

STK546585
Synonyms: prop- 2- en- 1- yl2- amino- 1- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK546586
Synonyms: [3- amino- 6- methyl- 4- (thiophen- 2- yl)thieno[2,3- b]pyridin- 2- yl](tricyclo[3.3.1.1~3,7~]dec- 1- yl)methanone
Smiles: Cc1nc2sc(c(c2c(c1)c1cccs1)N)C(=O)C12CC3CC(C2)CC(C1)C3

STK546587
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OCC=C

STK546589
Synonyms: 2- (piperidin- 1- yl)anthracene- 1,4- dione
Smiles: O=C1C=C(N2CCCCC2)C(=O)c2c1cc1ccccc1c2

STK546591
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- [2- (trifluoromethyl)phenyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3

STK546592
Synonyms: ethyl2- [({[3- cyano- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(ccc2C#N)c2cccs2)sc2c1CCCC2

STK546595
Synonyms: N,N- diethyl- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CC

STK546597
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (3,5- dichlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)n2nnc3c2cccc3)c2ccccc2C=C1

STK546600
Synonyms: N,N- dibutyl- 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)CCCC

STK546601
Synonyms: 11- (4- chlorophenyl)- 10- methyl- N- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)Cl)C)c1ccccc1

STK546602
Synonyms: 3- hydroxy- 1- methyl- 5- (2- nitrophenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C1C(=C(C(N1C)c1ccccc1[N+](=O)[O-])C(=O)c1ccccc1)O

STK546606
Synonyms: diethyl{(phenylamino)[2- (trifluoromethyl)phenyl]methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccccc1C(F)(F)F)Nc1ccccc1)OCC

STK546607
Synonyms: 3- (3,5- dimethylphenyl)- 11- (2- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK546608
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1ccc(cc1)F

STK546609
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)NCCc1ccccc1

STK546610
Synonyms: 2- {[6- iodo- 3- (2- methylphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK546611
Synonyms: 1- methoxypropan- 2- ylcyano[3- (dibutylamino)quinoxalin- 2- yl]acetate
Smiles: CCCCN(c1nc2ccccc2nc1C(C(=O)OC(COC)C)C#N)CCCC

STK546612
Synonyms: [(4- bromophenyl)sulfonyl][3- (3- methylpyridinium- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2cccc(c2)C)C(=O)c2c(C1=O)cccc2

STK546613
Synonyms: 2- [(E)- 2- (1,3- benzodioxol- 5- yl)ethenyl]- 3- (4- bromophenyl)- 6- iodoquinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccc3c(c2)OCO3)nc2c(c1=O)cc(cc2)I

STK546614
Synonyms: 3- hydroxy- 1- (2- hydroxyethyl)- 4- [(4- methylphenyl)carbonyl]- 5- (2- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: OCCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccc(cc1)C)O

STK546615
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(E)- (2,4,5- trimethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(OC)c(cc1OC)OC)CC

STK546616
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- tert- butylacetamide
Smiles: N#Cc1c(SCC(=O)NC(C)(C)C)nc(c(c1c1cccs1)C#N)N

STK546617
Synonyms: N- [(3- cyano- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophen- 2- yl)carbamothioyl]- 3,4,5- trimethoxybenzamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCCCCC2

STK546618
Synonyms: 1- butyl- 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- (4- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCN1C(c2ccc(cc2)OC)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK546620
Synonyms: 1,3- bis(2- methoxyphenyl)- 5- [(morpholin- 4- ylamino)methylidene]- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NN2CCOCC2)/C(=O)N(C1=S)c1ccccc1OC

STK546621
Synonyms: 2- (4- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}phenoxy)acetamide
Smiles: NC(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK546622
Synonyms: (2E)- 3- (4- fluorophenyl)- N- {[4- (2- methoxyphenyl)piperazin- 1- yl]carbonothioyl}prop- 2- enamide
Smiles: COc1ccccc1N1CCN(CC1)C(=S)NC(=O)/C=C/c1ccc(cc1)F

STK546623
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (4- hydroxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O)C

STK546624
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)cccc3

STK546625
Synonyms: butyl2- amino- 1- (3- chloro- 4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK546626
Synonyms: N,N- diethyl- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)N(CC)CC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546627
Synonyms: ethyl4- cyano- 5- ({[(3- cyano- 4,6- dimethylpyridin- 2- yl)sulfanyl]acetyl}amino)- 3- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc(C)cc(c1C#N)C

STK546628
Synonyms: N- (3- chloro- 4- fluorophenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Fc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK546630
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- {(E)- [3- (trifluoromethyl)phenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1cccc(c1)C(F)(F)F

STK546631
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)F)c(nn1c1ccccc1)C

STK546632
Synonyms: (5E)- 2- [4- (4- methylphenyl)piperazin- 1- yl]- 5- {4- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)[N+](=O)[O-])/S1

STK546634
Synonyms: propan- 2- yl2- amino- 1- [2- (4- methoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COc1ccc(cc1)CCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK546635
Synonyms: bis[2- (3,4- dimethoxyphenyl)- 2- oxoethyl]cyanocarbonodithioimidate
Smiles: N#C/N=C(/SCC(=O)c1ccc(c(c1)OC)OC)\SCC(=O)c1ccc(c(c1)OC)OC

STK546636
Synonyms: 1- benzyl- 5- (4- fluorophenyl)- 3- hydroxy- 4- [(4- nitrophenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)C1C(=C(C(=O)N1Cc1ccccc1)O)C(=O)c1ccc(cc1)[N+](=O)[O-]

STK546639
Synonyms: ethyl4- ({[2- amino- 1- (4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK546640
Synonyms: ethyl(2E,3E)- 3- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)- 2- (hydroxyimino)butanoate
Smiles: C/C(=N\NC(=O)c1nnn(c1C)c1nonc1N)/C(=N\O)/C(=O)OCC

STK546641
Synonyms: N- [1- (1- benzyl- 1H- benzimidazol- 2- yl)butyl]benzamide
Smiles: CCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccccc1

STK546643
Synonyms: 3- methyl- 2- (prop- 2- en- 1- yl)- 1- [4- (pyridin- 2- yl)piperazin- 1- yl]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: C=CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1ccccn1)c1ccccc1n2

STK546644
Synonyms: N- (3- chlorophenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)Cl)nc1c2cccc1

STK546646
Synonyms: (8S,8aR,11aS)- 10- (3,5- dichlorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H](C3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl

STK546648
Synonyms: N'- [(E)- furan- 2- ylmethylidene]- 3,4- dimethyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carbohydrazide
Smiles: O=C(c1sc(=S)n(c1C)C)N/N=C/c1ccco1

STK546649
Synonyms: ethyl4- {[10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK546650
Synonyms: [(4- fluorophenyl)sulfonyl][3- (4- {[(2- methylphenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl]azanide
Smiles: Fc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1ccccc1C

STK546651
Synonyms: N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 2- fluorobenzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccccc2F)/c2c1cccc2

STK546652
Synonyms: N- {2- [(E)- 2- (3- chlorophenyl)- 1- cyanoethenyl]- 4- phenyl- 1,3- thiazol- 5- yl}propanamide
Smiles: CCC(=O)Nc1sc(nc1c1ccccc1)/C(=C/c1cccc(c1)Cl)/C#N

STK546653
Synonyms: 5- [(2- methylphenyl)amino]- 3- (4- nitrobenzyl)- 1,3- thiazolidine- 2,4- dione
Smiles: O=C1SC(C(=O)N1Cc1ccc(cc1)[N+](=O)[O-])Nc1ccccc1C

STK546654
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK546655
Synonyms: N'~1~- [(3E)- 5- bromo- 2- oxo- 1- (propan- 2- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]- N'~5~- [(3Z)- 5- bromo- 2- oxo- 1- (propan- 2- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]pentanedihydrazide
Smiles: CC(N1C(=O)/C(=N/NC(=O)CCCC(=O)N/N=C/2\C(=O)N(c3c2cc(Br)cc3)C(C)C)/c2c1ccc(c2)Br)C

STK546656
Synonyms: 4- (phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)- 8- (3- fluorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)Oc1ccc(cc1)C(=O)c1ccccc1

STK546661
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- methoxy- 4- (2- phenylethoxy)phenyl]methylidene}- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCCc1ccccc1

STK546663
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N

STK546664
Synonyms: N- (diphenylmethyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546665
Synonyms: N- (1,4- dioxo- 3- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}- 1,4- dihydronaphthalen- 2- yl)benzenesulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)C/C=C/c2ccccc2)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1

STK546667
Synonyms: ethyl4- [11- (2- methoxybenzyl)- 4- oxo- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1OC

STK546668
Synonyms: 1- methoxypropan- 2- ylcyano[3- (4- methylpiperidin- 1- yl)quinoxalin- 2- yl]acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C)C#N)C

STK546669
Synonyms: (1'R,2'R)- 2'- (4- bromophenyl)- 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]1c1ccc(cc1)Br)C(=O)c1c(C2=O)cccc1

STK546670
Synonyms: ethyl5- (4- iodophenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1)I

STK546671
Synonyms: methyl(2Z)- 4- (furan- 2- yl)- 2- hydroxy- 4- oxobut- 2- enoate
Smiles: COC(=O)/C(=C/C(=O)c1ccco1)/O

STK546672
Synonyms: ethyl4- [(4- chlorophenyl)amino]- 2- methylquinoline- 6- carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(Nc1ccc(cc1)Cl)cc(n2)C

STK546673
Synonyms: (4Z)- 4- (3- chloro- 4- nitrobenzylidene)- 2- (thiophen- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Cl)[N+](=O)[O-])c1cccs1

STK546674
Synonyms: N,N- dibutyl- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3)CCCC

STK546675
Synonyms: 4- butyl- 7- [(3- methylbutyl)sulfanyl]- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)ncnc3SCCC(C)C

STK546676
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- (propan- 2- ylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SC(C)C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK546677
Synonyms: 1- methyl- 4- (3- methylpiperidin- 1- yl)[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: CC1CCCN(C1)c1nc2ccccc2n2c1nnc2C

STK546678
Synonyms: [(5- bromothiophen- 2- yl)sulfonyl][3- (3,5- dimethylpyridinium- 1- yl)quinoxalin- 2- yl]azanide
Smiles: Cc1cc(C)c[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(s1)Br

STK546679
Synonyms: 9- [(3- methylbutyl)sulfanyl]- 8- (3- methylphenyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1)C

STK546680
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (2,3,5- trimethylphenoxy)ethyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)cc(c1C)C

STK546682
Synonyms: ethyl4- cyano- 5- ({[(3- cyano- 5,6,7,8,9,10- hexahydrocycloocta[b]pyridin- 2- yl)sulfanyl]acetyl}amino)- 3- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc2CCCCCCc2cc1C#N

STK546683
Synonyms: (2'R,3'R)- 2'- (4- bromophenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: Brc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK546684
Synonyms: N- (diphenylmethyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546685
Synonyms: ethyl6- amino- 5- cyano- 2- {[(3- cyano- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl)sulfanyl]methyl}- 4- (2- fluorophenyl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc3CCCc3cc2C#N)OC(=C(C1c1ccccc1F)C#N)N

STK546687
Synonyms: N- [1- (1H- benzimidazol- 2- yl)butyl]- 4- tert- butylbenzamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)C(C)(C)C

STK546689
Synonyms: 2- methoxy- 4- [(E)- {2- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetyl]hydrazinylidene}methyl]phenyl2- methyl- 3- nitrobenzoate
Smiles: COc1cc(/C=N/NC(=O)Cn2nc(cc2C)[N+](=O)[O-])ccc1OC(=O)c1cccc(c1C)[N+](=O)[O-]

STK546692
Synonyms: 1- [4- (4- methylbenzyl)piperazin- 1- yl]- 3- (propan- 2- yl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(cc(n2c1nc1c2cccc1)N1CCN(CC1)Cc1ccc(cc1)C)C(C)C

STK546693
Synonyms: 2- [(2- ethyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- methyl- N- phenylacetamide
Smiles: CCc1nc(SCC(=O)N(c2ccccc2)C)c2c(n1)sc1c2CCCC1

STK546694
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC1=CCCCC1)C

STK546696
Synonyms: 2- amino- 1- benzyl- N- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cc(cc(c1)C)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK546697
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(2- chlorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(c1OCc1ccccc1Cl)Br

STK546698
Synonyms: 3- amino- N- (2,6- dimethylphenyl)- 4- (4- fluorophenyl)- 6- phenylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: Fc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1c(C)cccc1C)c1ccccc1

STK546699
Synonyms: methylN- [(5- bromo- 2- {[(2- chlorophenyl)carbonyl]amino}phenyl)(2- chlorophenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1ccccc1Cl)c1cc(Br)ccc1NC(=O)c1ccccc1Cl

STK546700
Synonyms: 4- acetyl- 1- butyl- 3- hydroxy- 5- (2- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)C)O

STK546702
Synonyms: 8- bromo- 4- (pyrrolidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC1

STK546703
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)- 3- phenoxypropanamide
Smiles: O=C(NCC1COc2c(O1)cccc2)CCOc1ccccc1

STK546704
Synonyms: 4- methyl- 9,10- diphenyl- 2,6- bis(tetrahydrofuran- 2- ylmethyl)hexahydro- 4,8- ethenopyrrolo[3,4- f]isoindole- 1,3,5,7(2H,6H)- tetrone
Smiles: O=C1N(CC2CCCO2)C(=O)C2C1C1C3C(=O)N(C(=O)C3C2(C(=C1c1ccccc1)c1ccccc1)C)CC1CCCO1

STK546705
Synonyms: 2- ethyl- 5- {[4- (methoxycarbonyl)phenyl]amino}- 5- oxopentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)Nc1ccc(cc1)C(=O)OC

STK546706
Synonyms: methyl(1R,2S,3S)- 3- [(4- chlorophenyl)carbamoyl]- 1- cyano- 2- (4- methoxyphenyl)- 1,2,3,10b- tetrahydropyrrolo[2,1- a]isoquinoline- 1- carboxylate
Smiles: COc1ccc(cc1)[C@@H]1[C@@H](C(=O)Nc2ccc(cc2)Cl)N2C([C@]1(C#N)C(=O)OC)c1ccccc1C=C2

STK546707
Synonyms: 5- (2- fluorophenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccccc1)O

STK546708
Synonyms: 4- {4- [(4- carboxyphenyl)amino]- 2- (ethoxycarbonyl)- 2- methyl- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoicacid
Smiles: CCOC(=O)C1(C)C=C(C(=O)N1c1ccc(cc1)C(=O)O)Nc1ccc(cc1)C(=O)O

STK546709
Synonyms: 1- {1- (4- methoxyphenyl)- 6- phenyl- 8- [4- (propan- 2- yl)phenyl]- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7,9- trien- 3- yl}ethanone
Smiles: COc1ccc(cc1)N1N=C(SC21C=CC(=NN2c1ccccc1)c1ccc(cc1)C(C)C)C(=O)C

STK546710
Synonyms: (5E)- 2- [4- (3- methylphenyl)piperazin- 1- yl]- 5- {4- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)[N+](=O)[O-])/S1

STK546713
Synonyms: ethyl6,8- dichloro- 4- [(3- hydroxyphenyl)amino]quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc(c1)O)cc(cc2Cl)Cl

STK546714
Synonyms: 10,10- dimethyl- 2- phenyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)c1ccccc1

STK546716
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (4- methylphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)C)C=Cc1c2cccc1

STK546717
Synonyms: prop- 2- en- 1- yl2- amino- 1- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

STK546718
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (benzyloxy)phenyl]methylidene}- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccccc1

STK546719
Synonyms: N- (4- methylphenyl)- 2,6- dioxo- 3,11b- dihydro- 2H,6H- chromeno[4',3':4,5]thiopyrano[2,3- d][1,3]thiazole- 5- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)C1=C2C(=O)Oc3c(C2c2c(S1)[nH]c(=O)s2)cccc3

STK546720
Synonyms: ethyl4- ({[(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]carbamothioyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1c(C)onc1c1ccccc1

STK546721
Synonyms: 2- (3- {2- [(3- nitrophenyl)carbonyl]hydrazinyl}- 3- oxopropyl)hexanoicacid
Smiles: CCCCC(C(=O)O)CCC(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]

STK546722
Synonyms: 2- methoxy- N- [(5Z)- 4- oxo- 5- (pyridin- 4- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: COc1ccccc1C(=O)NN1C(=S)S/C(=C\c2ccncc2)/C1=O

STK546723
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2)nc(c(c1c1cccs1)C#N)N

STK546724
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(E)- (2,4- dimethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1OC)OC)CC

STK546725
Synonyms: 2- {4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 3- phenyl- 1H- pyrazol- 1- yl}acetamide
Smiles: NC(=O)Cn1cc(c(n1)c1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK546726
Synonyms: 1- benzyl- 5- (2- fluorophenyl)- 3- hydroxy- 4- [(4- nitrophenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1F)Cc1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK546727
Synonyms: methyl4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK546728
Synonyms: N,4- dibutyl- N- ethyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)CCCC)CC

STK546729
Synonyms: 3- (4- bromophenyl)- 2- [(E)- 2- (4- chlorophenyl)ethenyl]- 6- iodoquinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1ccc(cc1)Br)I

STK546730
Synonyms: 2- [(5- amino- 1,3,4- thiadiazol- 2- yl)sulfanyl]- 1- (4- bromophenyl)ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc(s1)N

STK546732
Synonyms: N- [3- (4- benzylpiperazin- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]thiophene- 2- sulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)Cc2ccccc2)C(=O)c2c1cccc2)NS(=O)(=O)c1cccs1

STK546733
Synonyms: 3- (biphenyl- 4- yloxy)- 8- [(dimethylamino)methyl]- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F)C

STK546734
Synonyms: 3- [3- (2,3- dimethylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1C)C

STK546735
Synonyms: 3- (2,5- dimethoxyphenyl)- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: COc1ccc(c(c1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O)OC

STK546736
Synonyms: [3- (4- tert- butylpyridinium- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl](thiophen- 2- ylsulfonyl)azanide
Smiles: O=C1C(=C([N-]S(=O)(=O)c2cccs2)C(=O)c2c1cccc2)[n+]1ccc(cc1)C(C)(C)C

STK546737
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- [3- (trifluoromethyl)phenyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F)cccc3

STK546740
Synonyms: 1- (3,5- dichlorophenyl)- 3- (propylamino)pyrrolidine- 2,5- dione
Smiles: CCCNC1CC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl

STK546741
Synonyms: (2E)- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 3- (2- methoxyphenyl)prop- 2- enamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)/C=C/c2ccccc2OC)/c2c1cccc2

STK546743
Synonyms: (5E)- 5- {[(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]methylidene}- 1- ethyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=S)NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O

STK546744
Synonyms: 7- hydroxy- 8- [(4- methylpiperazin- 1- yl)methyl]- 3- (naphthalen- 2- yloxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK546747
Synonyms: methyl2- imino- 1- (4- methoxybenzyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: COC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1C

STK546748
Synonyms: 3- amino- 7,7- dimethyl- 7,8- dihydro- 5H- thieno[2,3- b]thiopyrano[3,4- e]pyridine- 2- carboxylicacid
Smiles: OC(=O)c1sc2c(c1N)cc1c(n2)CC(SC1)(C)C

STK546749
Synonyms: 5- ({[4- (diethylamino)phenyl]amino}methylidene)- 1,3- diphenyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CCN(c1ccc(cc1)N/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1)CC

STK546750
Synonyms: 4- [3- hydroxy- 5- (4- methylphenyl)- 2- oxo- 4- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrol- 1- yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1ccccc1

STK546751
Synonyms: 3- (4- fluorophenyl)- 1,5- diphenyl- 4,5- dihydro- 1H- pyrazole
Smiles: Fc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1

STK546752
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- cyclohex- 3- en- 1- ylmethylidene]- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCC=CC1

STK546753
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (4- fluorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)F)C(=O)c1ccccc1

STK546754
Synonyms: (8S,8aR,11aS)- 10- (2- methyl- 4- nitrophenyl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1cc(ccc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2)[N+](=O)[O-]

STK546755
Synonyms: propan- 2- yl({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetate
Smiles: CC(OC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2)C

STK546756
Synonyms: prop- 2- en- 1- yl2- amino- 1- (4- sulfamoylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)S(=O)(=O)N

STK546757
Synonyms: methyl2- amino- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC

STK546758
Synonyms: 4- [3- acetyl- 2- (2- fluorophenyl)- 4- hydroxy- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoicacid
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1F)c1ccc(cc1)C(=O)O

STK546759
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- methoxyphenyl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)OC)nnc1c1cccnc1

STK546760
Synonyms: (5E)- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 1- (4- methylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C\NCCCn2ccnc2)/C1=O

STK546761
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- N'- [(E)- (2,4,5- trimethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1nnn(c1C)c1nonc1N)OC

STK546762
Synonyms: 11- (3,5- dimethylphenyl)- 3- (2- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)cc(c1)C

STK546763
Synonyms: ethyl5- methyl- 3- (3- methylbutyl)- 4- oxo- 3,4- dihydrothieno[2,3- d]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)c1sc2c(c1C)c(=O)n(cn2)CCC(C)C

STK546764
Synonyms: 2- [(4- amino- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1)CCc1ccccc1

STK546765
Synonyms: 2- methoxyethyl2- amino- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK546766
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCC3(CC1)OCCO3)c(n2Cc1ccccc1)C

STK546767
Synonyms: N- {2- [(4,5- dimethyl- 1,3- benzothiazol- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 3- phenylpropanamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(n1)c(C)c(cc2)C)CCc1ccccc1

STK546769
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (diethylamino)- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN(c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)CC

STK546773
Synonyms: (1'R,2'R)- 1'- [(4- methoxyphenyl)carbonyl]- 2'- phenyl- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1

STK546774
Synonyms: 1- benzyl- 4- (2- phenoxyethyl)piperazine
Smiles: c1ccc(cc1)OCCN1CCN(CC1)Cc1ccccc1

STK546775
Synonyms: 2- amino- 1- (3- chloro- 4- fluorophenyl)- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F

STK546776
Synonyms: ethyl1- (3- {[(4- chlorophenyl)sulfonyl]amino}- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl)piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(cc2)Cl)C(=O)c2c(C1=O)cccc2

STK546777
Synonyms: N- (2,4- dimethylphenyl)- 2- [(5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK546778
Synonyms: ethyl1- (4- bromophenyl)- 8- (2,5- dimethylphenyl)- 6- phenyl- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7- diene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)CCC(=NN2c1ccccc1)c1cc(C)ccc1C)c1ccc(cc1)Br

STK546779
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- bromo- 5- ethoxy- 4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)cc(c1OCc1cccc2c1cccc2)Br

STK546780
Synonyms: 3- amino- N- [2- (trifluoromethoxy)phenyl]- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCCC1)Nc1ccccc1OC(F)(F)F

STK546781
Synonyms: 3- ethyl6- methyl4- {[4- (benzyloxy)phenyl]amino}quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)OCc1ccccc1)cc(cc2)C(=O)OC

STK546782
Synonyms: 3- tert- butyl- 7- {[2- (3- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CC1CCCN(C1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C

STK546783
Synonyms: (2Z)- 2- [3- chloro- 5- (4- fluorophenyl)- 2- (4- methylphenyl)- 1- benzoxepin- 4(5H)- ylidene]- N,N- dimethylethanamine
Smiles: CN(C/C=C/1\C(=C(Oc2c(C1c1ccc(cc1)F)cccc2)c1ccc(cc1)C)Cl)C

STK546784
Synonyms: 2- methyl- N'- {[(4- oxo- 3,4- dihydroquinazolin- 2- yl)sulfanyl]acetyl}benzohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)[nH]1)NNC(=O)c1ccccc1C

STK546785
Synonyms: 3- [3- (2,4- dichloro- 6- methylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Cl)Cl

STK546786
Synonyms: 3- [(dimethylamino)methyl]- 2,6,8- trimethylquinolin- 4- ol
Smiles: CN(Cc1c(C)nc2c(c1O)cc(cc2C)C)C

STK546787
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(4- methylbenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1ccc(cc1)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK546788
Synonyms: ethyl4- {2- (4- fluorophenyl)- 4- hydroxy- 3- [(4- methoxyphenyl)carbonyl]- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccc(cc1)OC)O

STK546789
Synonyms: 3- [4- (2- tert- butyl- 4- methylphenoxy)butyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc(cc1C(C)(C)C)C

STK546790
Synonyms: 3- hydroxy- 1- (4- hydroxyphenyl)- 5- (4- nitrophenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Oc1ccc(cc1)N1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccccc1

STK546791
Synonyms: N'~1~,N'~8~- bis[(3E)- 1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]octanedihydrazide
Smiles: O=C(N/N=C/1\c2ccccc2N(C1=O)C)CCCCCCC(=O)N/N=C/1\c2ccccc2N(C1=O)C

STK546792
Synonyms: 1- (4- chlorophenyl)- 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK546793
Synonyms: 5- {[3- (diethylamino)propyl]amino}- 6- methyl- 1,2,4- triazin- 3(2H)- one
Smiles: CCN(CCCNc1nc(=O)[nH]nc1C)CC

STK546794
Synonyms: N- (1,5- dihydro- 2,4- benzodioxepin- 3- ylmethyl)- 3- methylbutan- 1- amine
Smiles: CC(CCNCC1OCc2c(CO1)cccc2)C

STK546795
Synonyms: ethyl4- {[11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1

STK546796
Synonyms: N,N- dibutyl- 2- {[3- (4- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)CCCC

STK546797
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- butoxyphenyl)methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK546799
Synonyms: 3,4- difluoro- N- ({2- [(2- phenylquinolin- 4- yl)carbonyl]hydrazinyl}carbonothioyl)benzamide
Smiles: S=C(NC(=O)c1ccc(c(c1)F)F)NNC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK546801
Synonyms: 7- {[2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)ethyl]amino}- 2- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCC2(CC1)OCCO2

STK546802
Synonyms: 6- ethyl- 2- methyl- 3- {[methyl(1- methylpiperidin- 4- yl)amino]methyl}quinolin- 4- ol
Smiles: CCc1ccc2c(c1)c(O)c(c(n2)C)CN(C1CCN(CC1)C)C

STK546803
Synonyms: butyl2- amino- 1- (3- chloro- 4- fluorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F

STK546804
Synonyms: N- (3- chloro- 4- fluorophenyl)- 10- methyl- 8- phenyl- 11- [4- (propan- 2- yl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CC(c1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1)C

STK546805
Synonyms: 11- (4- tert- butylphenyl)- N- (2,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK546807
Synonyms: 4- {3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 2- oxo- 5- phenyl- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoicacid
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1ccc(cc1)C(=O)O

STK546808
Synonyms: butyl2- amino- 1- (4- hydroxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O

STK546809
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(4- chlorobenzyl)oxy]phenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccc(cc1)Cl

STK546810
Synonyms: 2,6- bis(hydroxymethyl)- 4- methylphenyl4- methylbenzenesulfonate
Smiles: OCc1cc(C)cc(c1OS(=O)(=O)c1ccc(cc1)C)CO

STK546812
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- bromophenyl)carbonyl]- 3- chloro- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)NC(=O)[C@H]2[C@H]2N1c1ccc(cc1C=C2)Cl

STK546813
Synonyms: 3- (3- bromophenyl)- 5- (4- ethylphenyl)- 3a,6a- dihydrospiro[furo[3,4- c]pyrrole- 1,2'- indene]- 1',3',4,6(3H,5H)- tetrone
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2c2cccc(c2)Br)C(=O)c2c(C1=O)cccc2

STK546814
Synonyms: methyl(1R,2R,3S,3aS)- 1- [(3- bromo- 4- methoxyphenyl)carbonyl]- 3- cyano- 2- (furan- 2- yl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccco2)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK546815
Synonyms: N- {[2- (phenylacetyl)hydrazinyl]carbonothioyl}pyridine- 3- carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)Cc1ccccc1

STK546816
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- bromo- 4- fluorophenyl)methylidene]- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1ccc(c(c1)Br)F

STK546817
Synonyms: 1- [2- (diethylamino)ethyl]- 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 5- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCN(CCN1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccc(cc1)OC)O)CC

STK546818
Synonyms: (3aR,4S,9aR,9bS)- 2- (1,3- benzodioxol- 5- yl)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)C(=O)c1ccccc1

STK546820
Synonyms: 2- (2- fluorophenyl)- N- (2- phenylethyl)quinazolin- 4- amine
Smiles: Fc1ccccc1c1nc(NCCc2ccccc2)c2c(n1)cccc2

STK546821
Synonyms: 3- [2- (4- tert- butyl- 2- methylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1C)C(C)(C)C

STK546822
Synonyms: 2- [(E)- 2- (4- bromophenyl)ethenyl]- 3- (2,5- dibromophenyl)- 6- iodoquinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)n1c(/C=C/c2ccc(cc2)Br)nc2c(c1=O)cc(cc2)I)Br

STK546823
Synonyms: methylN- [{5- bromo- 2- [(phenylcarbonyl)amino]phenyl}(2- chlorophenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1ccccc1Cl)c1cc(Br)ccc1NC(=O)c1ccccc1

STK546826
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(2- chlorobenzyl)oxy]phenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1COc1ccccc1)C(=O)N/N=C/c1cccc(c1)OCc1ccccc1Cl

STK546827
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (3- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccccc1

STK546828
Synonyms: 3- (2- methoxyphenyl)- 11- [2- (4- methoxyphenyl)ethyl]- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)CCn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1OC

STK546829
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2- methoxy- 5- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2)[N+](=O)[O-]

STK546830
Synonyms: 7- (4- methoxyphenyl)- 9- (4- nitrophenyl)- 5,7- dihydro- 6H- benzo[h][1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)[N+](=O)[O-])c1c(CC2)cccc1

STK546831
Synonyms: (5Z)- 3- (1,3- benzodioxol- 5- yl)- 5- [4- (octyloxy)benzylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc2c(c1)OCO2

STK546833
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(E)- {4- methoxy- 3- [(3- methyl- 4- nitrophenoxy)methyl]phenyl}methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)COc1ccc(c(c1)C)[N+](=O)[O-])OC)CC

STK546834
Synonyms: N- (2,4- dimethylphenyl)- 11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1C)C)c1ccccc1

STK546835
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2

STK546836
Synonyms: (2- methoxy- 5- {[4- (4- methylphenyl)phthalazin- 1- yl]amino}phenyl)(piperidin- 1- yl)methanone
Smiles: COc1ccc(cc1C(=O)N1CCCCC1)Nc1nnc(c2c1cccc2)c1ccc(cc1)C

STK546837
Synonyms: N- ({4- [(2,6- dimethoxypyrimidin- 4- yl)sulfamoyl]phenyl}carbamothioyl)- 3,4- difluorobenzamide
Smiles: COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(c(c1)F)F

STK546839
Synonyms: N- {1- (3- butoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- chlorobenzenesulfonamide
Smiles: CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C

STK546840
Synonyms: 2- [4- (benzyloxy)- 3- methoxyphenyl]- 5- (biphenyl- 4- yl)- 4- phenyl- 1H- imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1[nH]c(c(n1)c1ccccc1)c1ccc(cc1)c1ccccc1

STK546841
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (4- methyl- 2- nitrophenoxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1[N+](=O)[O-])C

STK546842
Synonyms: 2- [(3,4- dichlorobenzyl)sulfanyl]- 5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazole
Smiles: Clc1ccc(cc1Cl)CSc1nnc(s1)SCc1cccc2c1cccc2

STK546843
Synonyms: ethyl5- methyl- 3- {[(2,4,5- trimethylphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cc(C)c(cc1C)C)cc(cc2)C

STK546844
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- methoxy- 3- [(2,4,6- trichlorophenoxy)methyl]phenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1COc1c(Cl)cc(cc1Cl)Cl)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK546845
Synonyms: 2- methoxyethyl2- amino- 1- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK546846
Synonyms: N- [1- (1- benzyl- 1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 3- methylbutanamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)CC(C)C

STK546847
Synonyms: 2- amino- 1- (3- chloro- 4- methoxyphenyl)- N- phenyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1

STK546848
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- (1H- benzotriazol- 1- ylmethyl)- 4- methoxyphenyl]methylidene}- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1Cn1nnc2c1cccc2)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK546849
Synonyms: 3- butyl- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SC(C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546851
Synonyms: 11- (3,5- dichlorophenyl)- 3- (3,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cc(C)cc(c1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(Cl)cc(c1)Cl

STK546852
Synonyms: 2- [(5Z)- 5- (2,4- dimethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]pentanedioicacid
Smiles: COc1cc(OC)ccc1/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O

STK546853
Synonyms: 3- bromo- N- (3,5- dichlorophenyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Clc1cc(cc(c1)Cl)NC(=O)c1coc(=O)c(c1)Br

STK546854
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK546855
Synonyms: propan- 2- yl2- amino- 1- [2- (4- sulfamoylphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)S(=O)(=O)N)C

STK546856
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(1E)- 1- [4- (benzyloxy)phenyl]ethylidene}- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1C)c1nonc1N)/c1ccc(cc1)OCc1ccccc1

STK546857
Synonyms: (3aR,4S,9aR,9bS)- 2- (2- chlorophenyl)- 4- [(4- chlorophenyl)carbonyl]- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)C(=O)c1ccccc1

STK546858
Synonyms: N- (3- cyano- 1- phenyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl)- 4- methylbenzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)C)n(c2c1nc1ccccc1n2)c1ccccc1

STK546860
Synonyms: 7- (4- chlorophenyl)- N,N- diethyl- 7H- chromeno[2',3':4,5]pyrimido[1,6- a]benzimidazol- 3- amine
Smiles: CCN(c1ccc2c(c1)OC1=NC(n3c(C1=C2)nc1c3cccc1)c1ccc(cc1)Cl)CC

STK546861
Synonyms: 2- propyl- 5- (thiophen- 2- yl)- 4H- thieno[2,3- d][1,3]oxazin- 4- one
Smiles: CCCc1oc(=O)c2c(n1)scc2c1cccs1

STK546862
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1c1cccnc1

STK546863
Synonyms: N- (3- methylphenyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546864
Synonyms: N- (4- bromophenyl)- 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK546865
Synonyms: 3- (4- chlorophenyl)- 3- [4- hydroxy- 2- methyl- 5- (propan- 2- yl)phenyl]- 2- benzofuran- 1(3H)- one
Smiles: Clc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1cc(C(C)C)c(cc1C)O

STK546866
Synonyms: N- {[4- (carbamimidoylsulfamoyl)phenyl]carbamothioyl}- 4- fluorobenzamide
Smiles: NC(=N)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)F

STK546867
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(2,6- dichlorobenzyl)oxy]- 5- nitrophenyl}methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1C)c1nonc1N)N/N=C/c1cc(ccc1OCc1c(Cl)cccc1Cl)[N+](=O)[O-]

STK546868
Synonyms: 7- tert- butyl- 2- (butylsulfanyl)- 3- (3- methylphenyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC(C3)C(C)(C)C

STK546869
Synonyms: 3- amino- N- (2- chlorobenzyl)- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccccc1Cl

STK546870
Synonyms: N- (4- methoxyphenyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccc(cc2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546871
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)CC1CCCO1

STK546872
Synonyms: 2- cyano- 2- [3- (3,5- dimethylpiperidin- 1- yl)quinoxalin- 2- yl]- N- (1- phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C(=O)NC(c1ccccc1)C

STK546873
Synonyms: 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]- N'- [(E)- phenylmethylidene]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1

STK546874
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3,4- dichlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK546875
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- {(1E)- 1- [4- (2- methylpropyl)phenyl]ethylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)CC(C)C)\C)CC

STK546876
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK546877
Synonyms: 2- (1,1,1,3,3,3- hexafluoropropan- 2- ylidene)- 4H- [1,3]oxathiolo[4,5- c]chromen- 4- one
Smiles: O=c1oc2ccccc2c2c1SC(=C(C(F)(F)F)C(F)(F)F)O2

STK546878
Synonyms: 5- {4- [(3- bromophenyl)amino]phthalazin- 1- yl}- 2- methyl- N- (pyridin- 3- ylmethyl)benzenesulfonamide
Smiles: Brc1cccc(c1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCc1cccnc1)C

STK546879
Synonyms: 1- (4- acetylphenyl)- 3- (2- methoxydibenzo[b,d]furan- 3- yl)thiourea
Smiles: COc1cc2c(cc1NC(=S)Nc1ccc(cc1)C(=O)C)oc1c2cccc1

STK546881
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(dimethylamino)methyl]- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)N(C)C)C

STK546882
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- fluoro- N- [1- (4- fluorophenyl)- 2,5- dioxopyrrolidin- 3- yl]benzamide
Smiles: Fc1cccc(c1)C(=O)N(C1CC(=O)N(C1=O)c1ccc(cc1)F)Cc1ccc2c(c1)OCO2

STK546883
Synonyms: 11- [4- (dimethylamino)phenyl]- 10- methyl- N- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)N(C)C)C)c1ccccc1

STK546884
Synonyms: 3- hydroxy- 5- (4- hydroxy- 3- methoxyphenyl)- 1- (4- methoxyphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(c(c1)OC)O)C(=O)c1ccccc1)O

STK546885
Synonyms: 2- (4- ethylpiperazin- 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)CC)/C1=O

STK546886
Synonyms: {3- [4- (3- chlorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}[(4- methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)Cl

STK546887
Synonyms: (5E)- 5- (carbamoylimino)- 3- (1- phenylpropan- 2- yl)- 4,5- dihydro- 1,2,3- oxadiazol- 3- ium- 4- ide
Smiles: CC([N+]1=NO/C(=N/C(=O)N)/[CH-]1)Cc1ccccc1

STK546891
Synonyms: 6- iodo- 3- (naphthalen- 1- yl)- 2- [(E)- 2- (4- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)[N+](=O)[O-])c1cccc2c1cccc2

STK546892
Synonyms: (2E)- 2- cyano- N- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [4- (propan- 2- yl)phenyl]prop- 2- enamide
Smiles: CCOc1ccc(cc1)c1csc(n1)NC(=O)/C(=C/c1ccc(cc1)C(C)C)/C#N

STK546893
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2,4- dichlorobenzyl)oxy]phenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N

STK546894
Synonyms: 5- (3- fluorophenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(=O)C(=C(C1c1cccc(c1)F)C(=O)c1ccccc1)O

STK546895
Synonyms: N- (3- chloro- 4- fluorophenyl)- 11- (4- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK546896
Synonyms: [(4- bromophenyl)sulfonyl][1,4- dioxo- 3- (pyridinium- 1- yl)- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccccc2)C(=O)c2c(C1=O)cccc2

STK546897
Synonyms: 4- (2,6- dimethylmorpholin- 4- yl)- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: CC1OC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)C

STK546898
Synonyms: 6- hydroxy- 3- (2- methylphenyl)- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Cc1ccccc1n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK546899
Synonyms: 2- (4- ethoxy- 3- methoxyphenyl)- 10- iminotetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: CCOc1ccc(cc1OC)C1OC23CCCCC3C(C1(C#N)C(=N)O2)(C#N)C#N

STK546900
Synonyms: 1- (benzyloxy)- 3- (4- methylphenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: Cc1ccc(cc1)c1c(=O)n(OCc2ccccc2)c2c([n+]1[O-])cccc2

STK546901
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (4- methylphenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C)C(=O)c1ccccc1

STK546902
Synonyms: ethyl5- bromo- 3- ({[3- (trifluoromethyl)phenyl]carbonyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C(F)(F)F)cc(cc2)Br

STK546904
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (4- bromophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK546905
Synonyms: 2- (hexylsulfanyl)- 6- iodo- 3- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCCCCCSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)OC)I

STK546907
Synonyms: 6- hydroxy- 3- (prop- 2- en- 1- yl)- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: C=CCn1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK546909
Synonyms: 2- (4- nitrophenyl)butanedioicacid
Smiles: OC(=O)CC(c1ccc(cc1)[N+](=O)[O-])C(=O)O

STK546911
Synonyms: 1- methyl- 7- {[2- (2- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CC1CCCCN1CCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK546912
Synonyms: 11- (3- methoxyphenyl)- 3- (4- methoxyphenyl)- 10- (phenylcarbonyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)OC)C(=O)c1ccccc1

STK546913
Synonyms: 4- methyl- 2- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]phthalazin- 1(2H)- one
Smiles: CN1CCN(CC1)C(=O)Cn1nc(C)c2c(c1=O)cccc2

STK546914
Synonyms: 2- [3- (4- benzylpiperazin- 1- yl)quinoxalin- 2- yl]- 2- cyano- N- [2- (4- methoxyphenyl)ethyl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C(=O)NCCc1ccc(cc1)OC

STK546915
Synonyms: 2- methoxyethyl2- amino- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCCOC

STK546918
Synonyms: 2- amino- 1- (2- chlorobenzyl)- N- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl)NCC1CCCO1

STK546919
Synonyms: 3- (methylsulfanyl)- 5- phenyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK546920
Synonyms: 3- amino- N- (2,5- dichlorophenyl)- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1cc(Cl)ccc1Cl

STK546921
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nc2c(c1=O)cccc2

STK546922
Synonyms: 3- (1- benzyl- 1H- indol- 3- yl)- 1- (naphthalen- 2- yl)pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccc2c(c1)cccc2)c1cn(c2c1cccc2)Cc1ccccc1

STK546924
Synonyms: 3- bromo- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2cccc(c2)Br)/c2c1cccc2

STK546925
Synonyms: 2- amino- 1- (3,5- dimethylphenyl)- N- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK546927
Synonyms: ethyl2- ({[(3,4- difluorophenyl)carbonyl]carbamothioyl}amino)- 1,4,5,6,7,8- hexahydrocyclohepta[b]pyrrole- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(c(c2)F)F)[nH]c2c1CCCCC2

STK546928
Synonyms: 2- amino- 1- (4- chloro- 3- nitrophenyl)- N- cyclohexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl)NC1CCCCC1

STK546929
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- methoxy- 4- [(3- methylbenzyl)oxy]phenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1cccc(c1)C)Br

STK546930
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK546932
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(2- chlorobenzyl)oxy]- 5- ethoxyphenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OCc1ccccc1Cl)Br

STK546933
Synonyms: ethyl2- [(2,4- dichlorophenyl)amino]- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1sc(nc1C)Nc1ccc(cc1Cl)Cl

STK546936
Synonyms: 11- [4- (dimethylamino)phenyl]- N- (2,5- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)N(C)C)c(nn1c1ccccc1)C)C

STK546938
Synonyms: 3- [2- (4- bromo- 2,6- dimethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)cc(cc1C)Br

STK546939
Synonyms: methyl2- ({[(3,4,5- trimethoxyphenyl)carbonyl]carbamothioyl}amino)- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCCCCC2

STK546940
Synonyms: 5- methyl- 2- (propan- 2- yl)cyclohexyl[4- (dimethylamino)phenyl][(4- methylphenyl)(phenylamino)methyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)C)Nc1ccccc1)c1ccc(cc1)N(C)C)C(C)C

STK546941
Synonyms: 3- [2- (2- tert- butyl- 4- methylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1C(C)(C)C)C

STK546942
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546943
Synonyms: N'- {(E)- [1- (4- ethylphenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}benzohydrazide
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O

STK546944
Synonyms: 2- ethyl- 4- [(4- methoxybenzyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCc1nc(SCc2ccc(cc2)OC)c2c(n1)sc1c2CC(OC1)(C)C

STK546946
Synonyms: 5- (2- acetyl- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 6- hydroxy- 3- phenyl- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=S)n(c1=O)c1ccccc1)cccc2

STK546947
Synonyms: 4- amino- N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: Fc1cccc(c1/C=N/N=C(/c1nonc1N)\N)Cl

STK546949
Synonyms: 4- (phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)- 8- (2- fluorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@@H]1N2c3ccccc3C=C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F)Oc1ccc(cc1)C(=O)c1ccccc1

STK546950
Synonyms: N- [1- (1- benzyl- 1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]thiophene- 2- carboxamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1cccs1

STK546951
Synonyms: 2- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}- 6- methoxyphenylbenzoate
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1OC(=O)c1ccccc1)OC)CC

STK546952
Synonyms: 3- methylbenzylN'- cyano- N- (2- fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1ccccc1F)\SCc1cccc(c1)C

STK546953
Synonyms: 4- amino- N'- [(E)- pyridin- 2- ylmethylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: N/C(=N\N=C\c1ccccn1)/c1nonc1N

STK546954
Synonyms: N,N- dibutyl- 2- [(2- phenyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: CCCCN(C(=O)CSc1nc(nc2c1c1CCCCc1s2)c1ccccc1)CCCC

STK546956
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCc3c2cccc3)c2nonc2N)cc(c1OCc1ccc(cc1)F)Br

STK546957
Synonyms: methyl2- amino- 1- (4- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)OC

STK546958
Synonyms: 11- (3- bromophenyl)- N- (3- chloro- 4- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Br)c(nn1c1ccccc1)C

STK546959
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- bromophenyl)methylidene]- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Br

STK546960
Synonyms: {3- [1- (3- {[(4- methoxyphenyl)carbonyl]amino}propyl)- 1H- imidazol- 3- ium- 3- yl]- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl}(phenylsulfonyl)azanide
Smiles: COc1ccc(cc1)C(=O)NCCCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2

STK546961
Synonyms: ethyl4- {[11- (4- tert- butylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK546962
Synonyms: 3- [(4- chlorophenyl)sulfonyl]- 1- cyclohexyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Clc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)C1CCCCC1

STK546963
Synonyms: 2- methoxyethylcyano[3- (piperidin- 1- yl)quinoxalin- 2- yl]acetate
Smiles: COCCOC(=O)C(c1nc2ccccc2nc1N1CCCCC1)C#N

STK546964
Synonyms: N- (4- bromophenyl)- 2- [(5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK546965
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (3- chlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1)Cl)C=Cc1c2cccc1

STK546966
Synonyms: N- (2,4- dimethylphenyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK546967
Synonyms: 8- chloro- 4- (2,6- dimethylmorpholin- 4- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CC1OC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK546968
Synonyms: 4- acetyl- 3- hydroxy- 1- (4- hydroxyphenyl)- 5- (3- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cccc(c1)C1C(=C(C(=O)N1c1ccc(cc1)O)O)C(=O)C

STK546969
Synonyms: 1- [1- (3- chlorophenyl)- 8- (4- ethylphenyl)- 6- phenyl- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7- dien- 3- yl]ethanone
Smiles: CCc1ccc(cc1)C1=NN(C2(CC1)SC(=NN2c1cccc(c1)Cl)C(=O)C)c1ccccc1

STK546971
Synonyms: 2- (4- ethylphenyl)- 9- phenyltetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccccc2)CCC1

STK546972
Synonyms: propan- 2- yl2- amino- 1- (4- chlorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)Cl)C

STK546973
Synonyms: 1- benzyl- 2- imino- N- (2- methoxyethyl)- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1

STK546974
Synonyms: N- [4- (4,4- dimethyl- 3,5- diphenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)benzyl]- 1- ethyl- 1H- benzimidazol- 2- amine
Smiles: CCn1c(NCc2ccc(cc2)N2N=C(C(C2c2ccccc2)(C)C)c2ccccc2)nc2c1cccc2

STK546976
Synonyms: N- [2- (2- amino- 3- cyano- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl)ethyl]- 4- methylbenzenesulfonamide
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)CCNS(=O)(=O)c1ccc(cc1)C

STK546977
Synonyms: 4- {6- [(3- chlorophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: Clc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)O)O)C)c1ccccc1

STK546978
Synonyms: (phenylsulfonyl)(3- {3- [(thiophen- 2- ylcarbonyl)amino]pyridinium- 1- yl}quinoxalin- 2- yl)azanide
Smiles: O=C(c1cccs1)Nc1ccc[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK546979
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- {[3- cyano- 6- methyl- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc(cc1c1cccs1)C

STK546980
Synonyms: (4Z)- 2- (3- nitrophenyl)- 4- (4- propoxybenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: CCCOc1ccc(cc1)/C=C/1\N=C(OC1=O)c1cccc(c1)[N+](=O)[O-]

STK546982
Synonyms: (5Z)- 3- (4- bromophenyl)- 5- [4- (octyloxy)benzylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)Br

STK546984
Synonyms: N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 2- (4- methoxyphenyl)acetamide(non- preferredname)
Smiles: N#CCCCN1c2ccccc2/C(=N/NC(=O)CNC(=O)Cc2ccc(cc2)OC)/C1=O

STK546985
Synonyms: 11- (4- tert- butylphenyl)- 3- (4- methoxyphenyl)- 10- (phenylacetyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)C(C)(C)C)C(=O)Cc1ccccc1

STK546986
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(3- chlorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(c1OCc1cccc(c1)Cl)Br

STK546987
Synonyms: [(4- bromophenyl)sulfonyl][3- (1- ethenyl- 1H- imidazol- 3- ium- 3- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: C=Cn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK546988
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]- 2- {[4- (4- methylphenyl)- 5- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccccc1)N/N=C/c1c[nH]c2c1cccc2

STK546989
Synonyms: bis[5- methyl- 2- (propan- 2- yl)cyclohexyl][hydroxy(4- methylphenyl)methyl]phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)C)O)OC1CC(C)CCC1C(C)C)C(C)C

STK546991
Synonyms: 11- (3- chlorophenyl)- N- (2,5- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cc(C)ccc1C)c1ccccc1

STK546992
Synonyms: 2- amino- 1- (4- chlorophenyl)- N- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Cl

STK546995
Synonyms: 2- cyano- 2- {3- [4- (3,4- dimethoxybenzyl)piperazin- 1- yl]quinoxalin- 2- yl}- N- (2- phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc(c(c1)OC)OC)C(=O)NCCc1ccccc1

STK546996
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (4- bromophenyl)ethylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)Br)\C

STK546997
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- benzylacetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)NCc1ccccc1

STK546998
Synonyms: 4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 2,6- dimethoxyphenylbenzoate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OC(=O)c1ccccc1)OC

STK546999
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3,5- dichlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(Cl)cc(c1)Cl

STK547001
Synonyms: 4- (butylsulfanyl)- 2- ethyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCSc1nc(CC)nc2c1c1CC(C)(C)OCc1s2

STK547003
Synonyms: 8- chloro- 4- (3,5- dimethylpiperidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CC1CC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK547005
Synonyms: 5- (biphenyl- 4- yl)- 2- (3- bromo- 4- methoxyphenyl)- 4- phenyl- 1H- imidazole
Smiles: COc1ccc(cc1Br)c1nc(c([nH]1)c1ccc(cc1)c1ccccc1)c1ccccc1

STK547006
Synonyms: (3aS,6R)- 2- (2- fluorophenyl)- 3- (2- methylprop- 2- en- 1- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: CC(=C)CC1N(C(=O)C2[C@]31C=C[C@H](O3)C2C(=O)O)c1ccccc1F

STK547007
Synonyms: ethylN- (6- chloro- 1,3- benzothiazol- 2- yl)- 3,3,3- trifluoro- 2- (pentanoylamino)alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nc2c(s1)cc(cc2)Cl

STK547008
Synonyms: 3- (4- bromophenyl)- 5- (2- methoxyphenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: COc1ccccc1C1CC(=NN1c1ccccc1)c1ccc(cc1)Br

STK547009
Synonyms: 1- methoxypropan- 2- yl[3- (4- benzylpiperazin- 1- yl)quinoxalin- 2- yl](cyano)acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)C#N)C

STK547011
Synonyms: methyl5- chloro- 3- [(3- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}propanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)Cl

STK547012
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- N'- [(E)- {3- [(4- methylbenzyl)oxy]phenyl}methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK547013
Synonyms: methyl3- {[(2E)- 3- phenylprop- 2- enoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)/C=C/c1ccccc1)cccc2

STK547014
Synonyms: 5- {[4- (ethoxycarbonyl)phenyl]amino}- 2- ethyl- 5- oxopentanoicacid
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCC(C(=O)O)CC

STK547016
Synonyms: 11- (4- tert- butylphenyl)- N- (3,5- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK547017
Synonyms: 3- (benzylsulfanyl)- 5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: c1ccc(cc1)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK547019
Synonyms: 11- benzyl- 3- (2- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK547020
Synonyms: 2- amino- 7,9- dimethyl- 5- oxo- 4- phenyl- 5,6- dihydro- 4H- pyrano[2,3- d]thieno[3,2- b:5,4- b']dipyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1)c(=O)[nH]c1c2sc2c1c(C)cc(n2)C

STK547021
Synonyms: 1- [(3- methoxyphenyl)amino]- 3- methyl- 2- (3- methylbutyl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: COc1cccc(c1)Nc1c(CCC(C)C)c(C)c(c2n1c1ccccc1n2)C#N

STK547022
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (piperidin- 1- ylmethyl)- N'- [(E)- (2,3,4- trimethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc(c1OC)OC

STK547023
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- methoxy- 4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1cccc2c1cccc2

STK547024
Synonyms: ethyl4- [({2- amino- 1- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl}carbonyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

STK547025
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(s1)SCc1ccccc1

STK547026
Synonyms: ethyl2- [({[5- (3- chloro- 1- benzothiophen- 2- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(o2)c2sc3c(c2Cl)cccc3)sc2c1CCCC2

STK547027
Synonyms: 3- [(tert- butoxycarbonyl)amino]- 3- (4- methoxyphenyl)propanoicacid
Smiles: COc1ccc(cc1)C(NC(=O)OC(C)(C)C)CC(=O)O

STK547028
Synonyms: methyl5- chloro- 3- {[(2- nitrophenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1[N+](=O)[O-])cc(cc2)Cl

STK547029
Synonyms: 2,2- dimethyl- 5- (morpholin- 4- yl)- 8- {[(2E)- 5- phenylhex- 2- en- 1- yl]sulfanyl}- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC(c1ccccc1)C/C=C/CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK547030
Synonyms: 6- chloro- 3- [5- (4- ethylphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 4- phenylquinolin- 2(1H)- one
Smiles: CCc1ccc(cc1)C1CC(=NN1S(=O)(=O)C)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK547031
Synonyms: 3- (3,5- dimethylphenyl)- 11- (4- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK547032
Synonyms: ethyl4- hydroxy- 2- (4- methoxyphenyl)- 1- (4- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)OC)c1ccc(cc1)[N+](=O)[O-]

STK547033
Synonyms: 4- (6- amino- 5- cyano- 3- methyl- 1- phenyl- 1,4- dihydropyrano[2,3- c]pyrazol- 4- yl)phenylacetate
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC(=O)C)c(C)nn2c1ccccc1

STK547034
Synonyms: 2- (hexylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCCCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547035
Synonyms: 3- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}phenyl3- methyl- 4- nitrobenzoate
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OC(=O)c1ccc(c(c1)C)[N+](=O)[O-])CC

STK547036
Synonyms: [(1S,2R,3S)- 2- (4- methoxyphenyl)- 1- nitro- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl](phenyl)methanone
Smiles: COc1ccc(cc1)[C@H]1[C@H]([N+](=O)[O-])C2N([C@@H]1C(=O)c1ccccc1)N=Cc1c2cccc1

STK547037
Synonyms: ethyl4- [(10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK547039
Synonyms: 8- [(2- ethylpiperidin- 1- yl)methyl]- 7- hydroxy- 3- (naphthalen- 2- yloxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK547040
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (naphthalen- 2- yl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)C(=O)c1ccccc1

STK547041
Synonyms: N'- [(E)- (2- hydroxyphenyl)methylidene]- 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1O

STK547042
Synonyms: 2- amino- N- cyclohexyl- 1- (9- ethyl- 9H- carbazol- 3- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CCCCC1

STK547043
Synonyms: naphthalen- 1- yl{4- (4- nitrophenyl)- 2- [(2,4,6- trimethylbenzyl)sulfanyl]- 1H- imidazol- 1- yl}methanone
Smiles: Cc1cc(C)c(c(c1)C)CSc1nc(cn1C(=O)c1cccc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]

STK547044
Synonyms: N- [5- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 1- phenyl- 1H- 1,2,4- triazol- 3- yl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1nc(n(n1)c1ccccc1)N1C(=O)c2c(C1=O)cccc2

STK547045
Synonyms: N- (4- bromo- 2- {[(2- hydrazinyl- 2- oxoethyl)amino](phenyl)methyl}phenyl)- 3- chlorobenzamide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(Br)ccc1NC(=O)c1cccc(c1)Cl)c1ccccc1

STK547047
Synonyms: 3- [3- (2- chlorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1Cl

STK547048
Synonyms: 4- [4,5- bis(4- chlorophenyl)- 1H- imidazol- 2- yl]- 2- ethoxyphenol
Smiles: CCOc1cc(ccc1O)c1[nH]c(c(n1)c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK547049
Synonyms: 4- (1H- benzimidazol- 2- ylsulfanyl)- 2- benzyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: c1ccc(cc1)Cc1nc(Sc2nc3c([nH]2)cccc3)c2c(n1)sc1c2CCCC1

STK547051
Synonyms: 2- {[6- (1,3- benzodioxol- 5- yl)- 3- cyanopyridin- 2- yl]sulfanyl}- N- (4- bromo- 2- methylphenyl)acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1ccc(cc1C)Br)c1ccc2c(c1)OCO2

STK547053
Synonyms: 2- (4- chlorophenyl)- 3- (4- {2- methoxy- 4- [(1E)- prop- 1- en- 1- yl]phenoxy}butyl)quinazolin- 4(3H)- one
Smiles: C/C=C/c1ccc(c(c1)OC)OCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK547054
Synonyms: 4- {[6- bromo- 3- (ethoxycarbonyl)quinolin- 4- yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)O)cc(cc2)Br

STK547055
Synonyms: 7- hydroxy- 8- [(2- methylpiperidin- 1- yl)methyl]- 3- (naphthalen- 2- yloxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK547056
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK547059
Synonyms: methyl5- bromo- 3- ({[4- (4- nitrophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])cc(cc2)Br

STK547061
Synonyms: (2E)- 4- oxo- 4- [2- (propan- 2- yl)- 1H- benzimidazol- 1- yl]but- 2- enoicacid
Smiles: OC(=O)/C=C/C(=O)n1c(nc2c1cccc2)C(C)C

STK547062
Synonyms: 2- [(3- bromobenzyl)sulfanyl]- 6- methyl- 5,6,7,8- tetrahydro- 1,6- naphthyridine- 3- carbonitrile
Smiles: N#Cc1cc2CN(C)CCc2nc1SCc1cccc(c1)Br

STK547063
Synonyms: 11- (4- chloro- 3- nitrophenyl)- 3- cyclohexyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: [O-][N+](=O)c1cc(ccc1Cl)n1c2nc3ccccc3nc2c2c1ncn(c2=O)C1CCCCC1

STK547064
Synonyms: 2- amino- 4- (4- butoxy- 3- methoxyphenyl)- 6- sulfanylpyridine- 3,5- dicarbonitrile
Smiles: CCCCOc1ccc(cc1OC)c1c(C#N)c(N)nc(c1C#N)S

STK547065
Synonyms: 2- (4- methoxyphenyl)- 3- {2- [2- methyl- 5- (propan- 2- yl)phenoxy]ethyl}quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(ccc1C)C(C)C

STK547067
Synonyms: 1- (3,4- dichlorophenyl)- 3- (naphthalen- 2- ylamino)pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccc(c(c1)Cl)Cl)Nc1ccc2c(c1)cccc2

STK547069
Synonyms: 2- chloro- 6,7- dimethoxy- 3- [1- (methylsulfonyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 5- yl]quinoline
Smiles: COc1cc2cc(c(nc2cc1OC)Cl)C1CC(=NN1S(=O)(=O)C)c1ccccc1

STK547070
Synonyms: N'- [(1Z)- 1- (3- bromophenyl)ethylidene]- 2- {[4- (4- methoxyphenyl)- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C(\c2cccc(c2)Br)/C)nnc1c1ccc(cc1)C

STK547071
Synonyms: (8S,8aR,11aS)- 10- (4- chlorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)cccc3

STK547072
Synonyms: 1- [2- (diethylamino)ethyl]- 5- (4- fluorophenyl)- 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCN(CCN1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccc(cc1)OC)O)CC

STK547073
Synonyms: N,N- diethyl- 2- {[3- (4- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)CC

STK547074
Synonyms: (2Z)- 2- cyano- N- [4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]- 3- [4- (propan- 2- yl)phenyl]prop- 2- enamide
Smiles: N#C/C(=C/c1ccc(cc1)C(C)C)/C(=O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK547075
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1cccnc1

STK547076
Synonyms: N- (diphenylmethyl)- 2- {[3- (2- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1n1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547077
Synonyms: (8S,8aR,11aS)- 10- (3- fluorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)cccc3

STK547078
Synonyms: 3- [3- (4- chloro- 2- methylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1C)Cl

STK547080
Synonyms: 2- methoxyethyl2- amino- 1- (2,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK547082
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (3,5- dichlorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)cccc3

STK547083
Synonyms: N- benzyl- 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547084
Synonyms: (8S,8aR,11aS)- 10- (2- methoxy- 5- nitrophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1OC)[N+](=O)[O-])cccc3

STK547085
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (4- nitrophenoxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)[N+](=O)[O-]

STK547086
Synonyms: 1- [(4- tert- butylbenzyl)oxy]- 3- (4- phenoxyphenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: [O-][n+]1c(c2ccc(cc2)Oc2ccccc2)c(=O)n(c2c1cccc2)OCc1ccc(cc1)C(C)(C)C

STK547087
Synonyms: methyl2- {3- hydroxy- 4- [(4- methoxy- 2- methylphenyl)carbonyl]- 2- oxo- 5- (pyridin- 3- yl)- 2,5- dihydro- 1H- pyrrol- 1- yl}- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: COc1ccc(c(c1)C)C(=O)C1=C(O)C(=O)N(C1c1cccnc1)c1sc(c(n1)C)C(=O)OC

STK547089
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- methoxy- 3- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}phenyl)methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1CSc1nnc(s1)C)/C=N/NC(=O)c1nnn(c1C)c1nonc1N

STK547090
Synonyms: 6- iodo- 3- (2- methoxyphenyl)- 2- [(2- oxo- 2- phenylethyl)sulfanyl]quinazolin- 4(3H)- one
Smiles: COc1ccccc1n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc(cc2)I

STK547091
Synonyms: methyl2- [(3aR,6aS)- 3- (3,4- dimethoxyphenyl)- 4,6- dioxo- 3a,4,6,6a- tetrahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(c(c1)OC)OC

STK547092
Synonyms: 5- (2- chlorophenyl)- 1- (4- fluorophenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1Cl)C(=O)c1ccccc1)O

STK547093
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (2- methoxynaphthalen- 1- yl)methylidene]acetohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1)cccc2

STK547094
Synonyms: 2- methoxyethyl2- amino- 1- (3- chloro- 4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK547095
Synonyms: (2'R,3'R)- 2'- (3- nitrophenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: O=C([C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cccc(c1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3)c1ccccc1

STK547096
Synonyms: methylcyano[3- (morpholin- 4- yl)quinoxalin- 2- yl]acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCOCC1)C(=O)OC

STK547097
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- (prop- 2- en- 1- ylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK547098
Synonyms: prop- 2- en- 1- ylcyano[3- (3,5- dimethylpiperidin- 1- yl)quinoxalin- 2- yl]acetate
Smiles: C=CCOC(=O)C(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C#N

STK547100
Synonyms: 3- [2- (2- ethoxyphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCOc1ccccc1OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547101
Synonyms: 1- (2- hydroxyethyl)- 2- imino- N- (2- methoxyethyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCOC

STK547102
Synonyms: N- [2,5- dioxo- 1- (4- propoxyphenyl)pyrrolidin- 3- yl]- N- [2- (4- methoxyphenyl)ethyl]benzamide
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)c1ccccc1)CCc1ccc(cc1)OC

STK547103
Synonyms: 3- chloro- 4- [(4- fluorophenyl)amino]- 1- (2- phenylethyl)- 1H- pyrrole- 2,5- dione
Smiles: Fc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)CCc1ccccc1

STK547104
Synonyms: N'- {(E)- [4- (benzyloxy)- 3- bromo- 5- methoxyphenyl]methylidene}- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(s2)C)cc(c1OCc1ccccc1)Br

STK547105
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- phenyl- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3

STK547106
Synonyms: N- (2,6- dichlorophenyl)cyclobutanecarboxamide
Smiles: O=C(C1CCC1)Nc1c(Cl)cccc1Cl

STK547108
Synonyms: 1- [1- (1H- benzimidazol- 2- yl)ethyl]- 3- phenylurea
Smiles: O=C(NC(c1nc2c([nH]1)cccc2)C)Nc1ccccc1

STK547109
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- (benzyloxy)phenyl]methylidene}- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1cccc(c1)OCc1ccccc1

STK547110
Synonyms: 1,1'- (9H- fluorene- 2,7- diyldisulfonyl)bis[4- (4- chlorobenzyl)piperazine]
Smiles: Clc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)c1ccc2c(c1)Cc1c2ccc(c1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl

STK547111
Synonyms: prop- 2- en- 1- yl4- [4- (benzyloxy)- 3- methoxyphenyl]- 5- cyano- 6- [(2- methoxy- 2- oxoethyl)sulfanyl]- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C#N)SCC(=O)OC

STK547112
Synonyms: (8R,8aS,11aR,11bR)- 8- [(3- bromo- 4- methoxyphenyl)carbonyl]- 10- (2,4- dimethylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2C=Cc3c([C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK547113
Synonyms: ethyl2- {[6- iodo- 4- oxo- 3- (prop- 2- en- 1- yl)- 3,4- dihydroquinazolin- 2- yl]sulfanyl}propanoate
Smiles: C=CCn1c(SC(C(=O)OCC)C)nc2c(c1=O)cc(cc2)I

STK547114
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2- methyl- 4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H](C3N1N=Cc1c3cccc1)C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-]

STK547115
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2,4- dichlorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)cccc3

STK547119
Synonyms: 2- [(4- amino- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK547120
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- butyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547123
Synonyms: 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCC(=O)N2CCCCC2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547125
Synonyms: 2- [(4,6- dimethylpyrimidin- 2- yl)sulfanyl]- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CSc1nc(C)cc(n1)C)N/N=C/C=C/c1ccccc1

STK547126
Synonyms: 2- [(2- butyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (diphenylmethyl)acetamide
Smiles: CCCCc1nc(SCC(=O)NC(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK547127
Synonyms: 2- (2- {5- [(4- methylphenyl)sulfanyl]- 3- nitro- 1H- 1,2,4- triazol- 1- yl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(CCn2nc(nc2Sc2ccc(cc2)C)[N+](=O)[O-])C(=O)c2c1cccc2

STK547129
Synonyms: N- (9H- xanthen- 9- yl)dodecanamide
Smiles: CCCCCCCCCCCC(=O)NC1c2ccccc2Oc2c1cccc2

STK547130
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (4- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2

STK547131
Synonyms: N- {1- (3- methoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK547132
Synonyms: 4- methylbenzylN'- cyano- N- (4- ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)N/C(=N/C#N)/SCc1ccc(cc1)C

STK547133
Synonyms: 2- amino- 1- butyl- N- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)CCCC

STK547134
Synonyms: [3- (3- {[(2- methylphenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl](phenylsulfonyl)azanide
Smiles: O=C(c1ccccc1C)Nc1ccc[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK547135
Synonyms: 6- chloro- 3- [5- (3,4- dimethoxyphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 4- phenylquinolin- 2(1H)- one
Smiles: COc1cc(ccc1OC)C1CC(=NN1S(=O)(=O)C)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK547136
Synonyms: 2- [3- (4- benzylpiperidin- 1- yl)quinoxalin- 2- yl]- 2- cyano- N- (1- phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1)C(=O)NC(c1ccccc1)C

STK547137
Synonyms: methyl5- (4- ethylphenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2)C(=O)OC

STK547139
Synonyms: 2- [(3- cyano- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl)sulfanyl]- N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)acetamide
Smiles: N#Cc1cc2CCCc2nc1SCC(=O)Nc1sc2c(c1C#N)CCC2

STK547140
Synonyms: N- {(E)- [4- (dodecyloxy)phenyl]methylidene}- 4- [(4- methyl- 3,6- dihydro- 2H- pyran- 3- yl)oxy]aniline
Smiles: CCCCCCCCCCCCOc1ccc(cc1)/C=N/c1ccc(cc1)OC1COCC=C1C

STK547141
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chloro- 6- fluorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK547142
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- hydroxy- 3,5- dimethoxyphenyl)methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1O)OC

STK547143
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547144
Synonyms: 4- hydroxy- 11- (thiophen- 2- yl)- 7,8,9,10- tetrahydropyrido[2',3':4,5]thieno[2,3- b]quinolin- 2(1H)- one
Smiles: O=c1cc(O)c2c([nH]1)c1c(s2)nc2c(c1c1cccs1)CCCC2

STK547145
Synonyms: 3- [3- (2- ethoxyphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCOc1ccccc1OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547146
Synonyms: N- [(4- benzylpiperidin- 1- yl)methyl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NCN1CCC(CC1)Cc1ccccc1

STK547147
Synonyms: ethyl4- {[4- (benzyloxy)phenyl]amino}- 6- methylquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)OCc1ccccc1)cc(cc2)C

STK547148
Synonyms: 3- [2- (4- chlorophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)Cl

STK547149
Synonyms: 2- amino- 1- (2- methoxybenzyl)- N- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1OC

STK547150
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)c(n2Cc1ccccc1)C

STK547151
Synonyms: 4- [4- (4- fluorobenzyl)piperazin- 1- yl]- 5- phenylthieno[2,3- d]pyrimidine
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c(cs2)c1ccccc1

STK547152
Synonyms: ethyl2- [({[3- cyano- 6- (thiophen- 2- yl)- 4- (thiophen- 3- yl)pyridin- 2- yl]sulfanyl}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(cc(c2C#N)c2cscc2)c2cccs2)sc2c1CCCC2

STK547153
Synonyms: N- ({2- [(2,4- dichlorophenyl)carbonyl]hydrazinyl}carbonothioyl)- 2- (thiophen- 2- yl)acetamide
Smiles: O=C(Cc1cccs1)NC(=S)NNC(=O)c1ccc(cc1Cl)Cl

STK547154
Synonyms: [(4- chlorophenyl)sulfonyl][1,4- dioxo- 3- (pyridinium- 1- yl)- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: Clc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccccc2)C(=O)c2c(C1=O)cccc2

STK547155
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- [(3- cyano- 4,5,6- trimethylpyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1c(NC(=O)CSc2nc(C)c(c(c2C#N)C)C)sc2c1CCC2

STK547156
Synonyms: methyl2- ({1,1,1,3,3,3- hexafluoro- 2- [(furan- 2- ylcarbonyl)amino]propan- 2- yl}amino)- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccco1

STK547157
Synonyms: 5- [(2,4- dichlorophenyl)amino]- 2- ethyl- 5- oxopentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)Nc1ccc(cc1Cl)Cl

STK547160
Synonyms: N- ({2- [(5- chloro- 2- methoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)- 3,4- difluorobenzamide
Smiles: COc1ccc(cc1C(=O)NNC(=S)NC(=O)c1ccc(c(c1)F)F)Cl

STK547162
Synonyms: 2- methoxyethyl2- amino- 1- (1,3- benzodioxol- 5- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

STK547163
Synonyms: N- (2,4- dimethoxyphenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2F)c(nn1c1ccccc1)C

STK547164
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547165
Synonyms: 2- amino- 6- [(2- bromobenzyl)sulfanyl]- 4- (thiophen- 2- yl)pyridine- 3,5- dicarbonitrile
Smiles: N#Cc1c(SCc2ccccc2Br)nc(c(c1c1cccs1)C#N)N

STK547166
Synonyms: 4- chloro- N- {1- (3- methylbutyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: CC(CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C)C

STK547167
Synonyms: 4- [(E)- {2- [5- (ethoxycarbonyl)- 4- methyl- 1,3- thiazol- 2- yl]hydrazinylidene}methyl]benzoicacid
Smiles: CCOC(=O)c1sc(nc1C)N/N=C/c1ccc(cc1)C(=O)O

STK547169
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nnc1c1cccnc1

STK547170
Synonyms: 4- amino- N'- [(E)- {3- bromo- 5- methoxy- 4- [(3- methylbenzyl)oxy]phenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: COc1cc(/C=N/N=C(\c2nonc2N)/N)cc(c1OCc1cccc(c1)C)Br

STK547171
Synonyms: 4- acetyl- 5- (2- chlorophenyl)- 3- hydroxy- 1- (2- phenylethyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C1N(CCc2ccccc2)C(C(=C1O)C(=O)C)c1ccccc1Cl

STK547172
Synonyms: 5- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 6- hydroxy- 1,3- diphenyl- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)n(c2ccccc2)c(=S)n(c1=O)c1ccccc1

STK547173
Synonyms: 2- {[2- (1,3- benzodioxol- 5- yl)- 2- oxoethyl]sulfanyl}- 3- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)OCO3)nc2c(c1=O)cccc2

STK547174
Synonyms: N- (4- chlorophenyl)- 4- [4- (prop- 2- yn- 1- yloxy)phenyl]phthalazin- 1- amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)Cl

STK547175
Synonyms: N,N- dibutyl- 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)N(CCCC)CCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547176
Synonyms: 6- amino- 4- (4- butoxy- 3- methoxyphenyl)- 3- (propan- 2- yl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c([nH]n2)C(C)C)C#N

STK547177
Synonyms: 3- [3- (2,6- dichlorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(Cl)cccc1Cl

STK547178
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- chloro- 4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547179
Synonyms: 4- {2- [(2E)- 2- (3- bromobenzylidene)hydrazinyl]- 2- oxoethoxy}- N'- [(E)- (3- bromophenyl)methylidene]benzohydrazide
Smiles: O=C(COc1ccc(cc1)C(=O)N/N=C/c1cccc(c1)Br)N/N=C/c1cccc(c1)Br

STK547180
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (2- methoxybenzyl)acetamide
Smiles: COc1ccccc1CNC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N

STK547181
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 5- (4- fluorophenyl)- 3- hydroxy- 1- (4- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK547182
Synonyms: N- ethyl- 2- imino- 1- (4- methoxybenzyl)- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CCNC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1

STK547183
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3,5- dichloro- 2- methoxyphenyl)methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(cc1Cl)Cl

STK547184
Synonyms: 3- ethyl6- methyl4- [(3,5- dimethylphenyl)amino]quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cc(C)cc(c1)C)cc(cc2)C(=O)OC

STK547185
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (2- methyl- 5- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK547186
Synonyms: 3- [(diethylamino)methyl]- 2,6,8- trimethylquinolin- 4- ol
Smiles: CCN(Cc1c(C)nc2c(c1O)cc(cc2C)C)CC

STK547187
Synonyms: propan- 2- yl2- amino- 1- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)OC(C)C)C

STK547189
Synonyms: 2- (benzylsulfanyl)- 3- butyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547190
Synonyms: 3- methyl- 2- (2- methylprop- 2- en- 1- yl)- 1- {[2- (morpholin- 4- yl)ethyl]amino}pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(C)c(CC(=C)C)c(n2c1nc1c2cccc1)NCCN1CCOCC1

STK547191
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- (pentylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK547192
Synonyms: 5- [4- (decyloxy)phenyl]- 4- (prop- 2- en- 1- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCCCCCCCCOc1ccc(cc1)c1n[nH]c(=S)n1CC=C

STK547193
Synonyms: 4- (2,5- dimethylpiperidin- 1- yl)- 8,8- dimethyl- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC1CCC(N(C1)c1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C)C

STK547195
Synonyms: 5- (2- chlorophenyl)- 1- (4- fluorophenyl)- 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1Cl)c1ccc(cc1)F

STK547196
Synonyms: 2- methoxyethyl2- amino- 1- (4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK547197
Synonyms: 4- [(3S)- 2,2- dicyano- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)cyclopropyl]phenylacetate
Smiles: N#CC1(C#N)[C@H](C1c1ccc(cc1)OC(=O)C)C(=O)C12CC3CC(C2)CC(C1)C3

STK547198
Synonyms: 2- benzyl- 3- methyl- 1- [(2,4,5- trichlorophenyl)amino]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(C)c(Cc2ccccc2)c(n2c1nc1c2cccc1)Nc1cc(Cl)c(cc1Cl)Cl

STK547199
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2

STK547201
Synonyms: N- [3- cyano- 1- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]- 4- fluorobenzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)F)n(c2c1nc1ccccc1n2)c1ccccc1OC

STK547202
Synonyms: ethyl5- bromo- 3- [(2- bromohexanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCCCC(C(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OCC)Br

STK547203
Synonyms: 1- (2- chlorobenzyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl

STK547204
Synonyms: N- (3- bromophenyl)- 4- [4- (prop- 2- yn- 1- yloxy)phenyl]phthalazin- 1- amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1cccc(c1)Br

STK547205
Synonyms: 1- butyl- 5- (4- fluorophenyl)- 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCN1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)OC

STK547206
Synonyms: 3- [(4- chlorophenyl)sulfonyl]- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Clc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK547207
Synonyms: (8S,8aR,11aS)- 10- (1,3- benzodioxol- 5- yl)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3

STK547208
Synonyms: 4- amino- N'- [(E)- {3- [(2,6- dichlorobenzyl)oxy]phenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: Clc1cccc(c1COc1cccc(c1)/C=N/N=C(\c1nonc1N)/N)Cl

STK547210
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (4- methylphenoxy)ethyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)C

STK547213
Synonyms: ethyl4- {3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 5- (2- nitrophenyl)- 2- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccc(cc1)OC)O

STK547215
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SCC(=C)C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK547216
Synonyms: [(4- bromophenyl)sulfonyl]{1,4- dioxo- 3- [4- (3- phenylpropyl)pyridinium- 1- yl]- 1,4- dihydronaphthalen- 2- yl}azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccc(cc2)CCCc2ccccc2)C(=O)c2c(C1=O)cccc2

STK547218
Synonyms: 3,11- bis(3,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cc(C)cc(c1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)cc(c1)C

STK547219
Synonyms: ethyl3- {[hydroxy(diphenyl)acetyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(c1ccccc1)(c1ccccc1)O)cc(cc2)OC

STK547220
Synonyms: 7- [(2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3ccccc3oc1cc2NCCN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK547222
Synonyms: 5- (4- chlorophenyl)- 3- hydroxy- 1- phenyl- 4- [(2E)- 3- phenylprop- 2- enoyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C1C(=C(C(=O)N1c1ccccc1)O)C(=O)/C=C/c1ccccc1

STK547223
Synonyms: N- (2,4- dimethylphenyl)- N- [(2- hydroxyquinolin- 3- yl)methyl]- 4- nitrobenzamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cc2ccccc2nc1O

STK547225
Synonyms: 2- [(E)- 2- (4- bromophenyl)ethenyl]- 6- iodo- 3- (naphthalen- 1- yl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1cccc2c1cccc2)I

STK547228
Synonyms: (9E)- 3- (4- chlorophenyl)- 9- (3- methoxybenzylidene)- 5- (3- methoxyphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1cccc(c1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1cccc(c1)OC)/CCC2

STK547229
Synonyms: 2- amino- 1- (3- chloro- 4- methoxyphenyl)- N- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cccc(c1)C

STK547230
Synonyms: benzylN'- cyano- N- (2- fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1ccccc1F)\SCc1ccccc1

STK547233
Synonyms: ethyl5- bromo- 3- {[(3,4,5- trimethoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cc(OC)c(c(c1)OC)OC)cc(cc2)Br

STK547234
Synonyms: (5E)- 5- (4- butoxybenzylidene)- 2- [4- (naphthalen- 1- yl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1cccc2c1cccc2

STK547235
Synonyms: 2- (2,4- dioxo- 3- phenyl- 1,3- thiazolidin- 5- yl)- N- [(4- ethoxyphenyl)carbamothioyl]acetamide
Smiles: CCOc1ccc(cc1)NC(=S)NC(=O)CC1SC(=O)N(C1=O)c1ccccc1

STK547236
Synonyms: 2- butyl- 3- methyl- 1- (undecylamino)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCCCCCCCCCNc1c(CCCC)c(C)c(c2n1c1ccccc1n2)C#N

STK547237
Synonyms: N- (2- ethoxyphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OCC)nnc1c1cccnc1

STK547238
Synonyms: 4- bromo- N- ({4- [(4,6- dimethylpyrimidin- 2- yl)sulfamoyl]phenyl}carbamothioyl)benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)Br)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C

STK547239
Synonyms: (8R,8aS,11aR)- 10- (3- bromophenyl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Brc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1N([C@H]2C(=O)c2ccccc2)N=Cc2c1cccc2

STK547240
Synonyms: 1- (4- methylpiperidin- 1- yl)- 3- [2- (prop- 2- en- 1- yl)phenoxy]propan- 2- ol
Smiles: C=CCc1ccccc1OCC(CN1CCC(CC1)C)O

STK547241
Synonyms: 3- (2- chloroethyl)- 7- methylquinolin- 2(1H)- one
Smiles: ClCCc1cc2ccc(cc2[nH]c1=O)C

STK547242
Synonyms: 2- {[6- iodo- 3- (2- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: COc1ccccc1n1c(SCC(=O)Nc2ccccc2C)nc2c(c1=O)cc(cc2)I

STK547243
Synonyms: 1- [5- (2- chloro- 7- methoxyquinolin- 3- yl)- 3- (4- chlorophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]ethanone
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)C)c1ccc(cc1)Cl)Cl

STK547244
Synonyms: (2E)- 2- (1,3- benzothiazol- 2(3H)- ylidene)- 4- (4- benzylpiperazin- 1- yl)- 3- oxobutanenitrile
Smiles: N#C/C(=c/1\sc2c([nH]1)cccc2)/C(=O)CN1CCN(CC1)Cc1ccccc1

STK547245
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 1- (8- methoxy- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1ccccc1F

STK547246
Synonyms: (5Z)- 5- (4- ethoxy- 3- methoxybenzylidene)- 3- (phenylamino)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)Nc1ccccc1

STK547247
Synonyms: 2- [(2- ethyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)N)c2c(n1)sc1c2CC(OC1)(C)C

STK547249
Synonyms: 3- [(diethylamino)methyl]- 2,7,8- trimethylquinolin- 4- ol
Smiles: CCN(Cc1c(C)nc2c(c1O)ccc(c2C)C)CC

STK547250
Synonyms: 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- 1- (piperidin- 1- yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547251
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- butoxyphenyl)methylidene]- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(CC)CC)c1nonc1N

STK547253
Synonyms: 1- [4- (hexyloxy)phenoxy]- 3- (2- methyl- 1H- benzimidazol- 1- yl)propan- 2- ol
Smiles: CCCCCCOc1ccc(cc1)OCC(Cn1c(C)nc2c1cccc2)O

STK547254
Synonyms: propan- 2- yl2- amino- 1- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COc1cc(ccc1OC)n1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK547255
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- [(E)- {3- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK547257
Synonyms: 1- (4- chlorophenyl)- 3- hydroxy- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccccc1

STK547258
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nc2c(c1=O)cccc2

STK547259
Synonyms: 3- [2- (2,5- dimethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)ccc1C

STK547260
Synonyms: 2- methoxyethyl2- amino- 1- (3- methylbutyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC(C)C

STK547261
Synonyms: ethyl2- imino- 1- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: CCOC(=O)c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1

STK547262
Synonyms: 3- (furan- 2- yl)- 1- (prop- 2- en- 1- yloxy)quinoxalin- 2(1H)- one4- oxide
Smiles: C=CCOn1c(=O)c(c2ccco2)[n+](c2c1cccc2)[O-]

STK547263
Synonyms: 3- hydroxy- 1- (4- methoxyphenyl)- 5- (3- nitrophenyl)- 4- [(4- nitrophenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)[N+](=O)[O-])O

STK547265
Synonyms: N- benzyl- 2- [(4- butyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)ncnc3SCC(=O)NCc1ccccc1

STK547266
Synonyms: 3- butyl- 2- (pentylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547267
Synonyms: 5- (4- fluorophenyl)- 1- [3- (trifluoromethyl)phenyl]- 3- {[3- (trifluoromethyl)phenyl]amino}- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)C1C=C(C(=O)N1c1cccc(c1)C(F)(F)F)Nc1cccc(c1)C(F)(F)F

STK547268
Synonyms: methyl2- (acetylamino)- N- (4,5- dimethyl- 1,3- benzothiazol- 2- yl)- 3,3,3- trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1sc2c(n1)c(C)c(cc2)C)NC(=O)C

STK547270
Synonyms: 2- amino- N- (1- phenylethyl)- 1- [3- (trifluoromethyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(c1ccccc1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F

STK547271
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3- chloro- 4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC)C

STK547272
Synonyms: 4- {6- [(2,5- dimethylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}- 2- methoxyphenol
Smiles: COc1cc(ccc1O)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)ccc1C)nc1c2cccc1

STK547273
Synonyms: 3- butyl- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547274
Synonyms: 2- amino- 6- [(2- methylbenzyl)sulfanyl]- 4- (thiophen- 2- yl)pyridine- 3,5- dicarbonitrile
Smiles: N#Cc1c(SCc2ccccc2C)nc(c(c1c1cccs1)C#N)N

STK547275
Synonyms: 2- [(7- benzyl- 4- oxo- 3- phenyl- 3,4,5,6,7,8- hexahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)Cc1ccccc1

STK547276
Synonyms: 2- imino- N- (2- methoxyethyl)- 5- oxo- 1- propyl- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CCCn1c(=N)c(cc2c1nc1ccccn1c2=O)C(=O)NCCOC

STK547277
Synonyms: N- (diphenylmethyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK547279
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547282
Synonyms: 4- (2- {2- amino- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}ethyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)S(=O)(=O)N

STK547283
Synonyms: N- [(9,10- dioxo- 9,10- dihydroanthracen- 2- yl)carbamothioyl]- 3,4,5- trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1

STK547284
Synonyms: 5- ({[4- (diethylamino)phenyl]amino}methylidene)- 1,3- bis(2- methoxyphenyl)- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CCN(c1ccc(cc1)N/C=C/1\C(=O)N(c2ccccc2OC)C(=S)N(C1=O)c1ccccc1OC)CC

STK547285
Synonyms: ethyl4- ({[2- amino- 1- (3,4- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C

STK547286
Synonyms: N- {(1Z)- 1- (3- nitrophenyl)- 3- oxo- 3- [(pyridin- 4- ylmethyl)amino]prop- 1- en- 2- yl}benzamide
Smiles: O=C(/C(=C/c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1)NCc1ccncc1

STK547287
Synonyms: 4- [(4- bromophenyl)carbonyl]- 5- (2- chlorophenyl)- 3- hydroxy- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(=O)C(=C(C1c1ccccc1Cl)C(=O)c1ccc(cc1)Br)O

STK547288
Synonyms: N- (2,4- dichlorophenyl)- 2- [(5- ethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1Cl)Cl)nn2)CCCC3

STK547289
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (piperidin- 1- ylmethyl)- N'- {(1E)- 1- [3- (2H- tetrazol- 2- yl)phenyl]ethylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C(/c1cccc(c1)n1nncn1)\C

STK547290
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- anthracen- 9- ylmethylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C/c1c2ccccc2cc2c1cccc2

STK547291
Synonyms: 3- (biphenyl- 4- yloxy)- 8- [(dibutylamino)methyl]- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCCCN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F)CCCC

STK547293
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (2,4,6- trimethylphenoxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1C)C

STK547294
Synonyms: 4- amino- N'- [(E)- {3- bromo- 5- methoxy- 4- [(2- methylbenzyl)oxy]phenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: COc1cc(/C=N/N=C(\c2nonc2N)/N)cc(c1OCc1ccccc1C)Br

STK547295
Synonyms: (5E)- 2- [4- (4- chlorophenyl)piperazin- 1- yl]- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Clc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK547296
Synonyms: 4- chloro- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccc(cc2)Cl)/c2c1cccc2

STK547297
Synonyms: prop- 2- en- 1- yl2- amino- 1- [2- (4- methoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)OC

STK547299
Synonyms: 1- methoxypropan- 2- yl[3- (4- benzylpiperidin- 1- yl)quinoxalin- 2- yl](cyano)acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1)C#N)C

STK547300
Synonyms: 3- (biphenyl- 4- yloxy)- 7- hydroxy- 8- [(4- methylpiperazin- 1- yl)methyl]- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F

STK547301
Synonyms: 2- fluorobenzylN'- cyano- N- (2- fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1ccccc1F)\SCc1ccccc1F

STK547302
Synonyms: 3- butyl- 2- (propylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCCC)CCCCC3

STK547303
Synonyms: 3- amino- N- [4- (trifluoromethoxy)phenyl]- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]thieno[3,2- e]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCCCC1)Nc1ccc(cc1)OC(F)(F)F

STK547304
Synonyms: 11- (3- chlorophenyl)- 10- methyl- N- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)C)c1ccccc1

STK547306
Synonyms: 1- (benzyloxy)- 3- [4- (decyloxy)phenyl]quinoxalin- 2(1H)- one4- oxide
Smiles: CCCCCCCCCCOc1ccc(cc1)c1c(=O)n(OCc2ccccc2)c2c([n+]1[O-])cccc2

STK547307
Synonyms: 3- butyl- 2- (methylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547308
Synonyms: [(4- bromophenyl)sulfonyl]{1,4- dioxo- 3- [1- (prop- 2- en- 1- yl)- 1H- imidazol- 3- ium- 3- yl]- 1,4- dihydronaphthalen- 2- yl}azanide
Smiles: C=CCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK547309
Synonyms: N'- [2- (2,4- dichlorophenoxy)propanoyl]- 1- hydroxynaphthalene- 2- carbohydrazide
Smiles: O=C(C(Oc1ccc(cc1Cl)Cl)C)NNC(=O)c1ccc2c(c1O)cccc2

STK547311
Synonyms: 3- ethyl6- methyl4- [(3- bromo- 4- methylphenyl)amino]quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(c(c1)Br)C)cc(cc2)C(=O)OC

STK547312
Synonyms: 3- [2- (2,6- dichlorophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(Cl)cccc1Cl

STK547313
Synonyms: 2- [(2- butyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- [(1- phenylcyclopentyl)methyl]acetamide
Smiles: CCCCc1nc(SCC(=O)NCC2(CCCC2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK547314
Synonyms: (8'R,8a'R)- 6'- amino- 8'- (2,6- difluorophenyl)- 8',8a'- dihydro- 1'H- spiro[1,3- dioxolane- 2,2'- naphthalene]- 5',7',7'(3'H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC1(C2)OCCO1)c1c(F)cccc1F)(C#N)C#N

STK547315
Synonyms: 4- (2- fluorophenoxy)- 2- (4- methoxyphenyl)quinazoline
Smiles: COc1ccc(cc1)c1nc(Oc2ccccc2F)c2c(n1)cccc2

STK547317
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- fluorobenzyl)oxy]phenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccccc1F

STK547320
Synonyms: methyl(7- methyl- 4- oxo- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 3(4H)- yl)acetate
Smiles: COC(=O)Cn1cnc2c(c1=O)c1CCC(Cc1s2)C

STK547321
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2- methyl- 4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H](C3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-]

STK547322
Synonyms: N- (4- chloro- 3- nitrophenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccccc1)n1c(=N2)c(Nc2ccc(c(c2)[N+](=O)[O-])Cl)nc2c1cccc2)c1ccccc1

STK547323
Synonyms: ethyl4- [(4- {[5- (3- chloro- 1- benzothiophen- 2- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}butanoyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCCSc1nnc(o1)c1sc2c(c1Cl)cccc2

STK547325
Synonyms: 5- phenyl- 3- (propan- 2- ylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CC(Sc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1)C

STK547326
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (2,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC)C

STK547327
Synonyms: N- (4- bromophenyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547328
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(3- methylbenzyl)oxy]phenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCOCC2)c2nonc2N)ccc1OCc1cccc(c1)C

STK547329
Synonyms: ethyl5- hydroxy- 2- [(4- methylpiperazin- 1- yl)methyl]- 1- phenyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(CN2CCN(CC2)C)n(c2c1cc(O)cc2)c1ccccc1

STK547331
Synonyms: N- ({2- [(2- methylphenyl)carbonyl]hydrazinyl}carbonothioyl)pyridine- 3- carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)c1ccccc1C

STK547333
Synonyms: N- methyl- 2- {[6- methyl- 2- (morpholin- 4- yl)- 5- nitropyrimidin- 4- yl]oxy}ethanamine
Smiles: CNCCOc1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1

STK547335
Synonyms: (1'R,2'R)- 2'- (4- bromophenyl)- 1'- [(4- methoxyphenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)Br)C(=O)c1c(C2=O)cccc1

STK547336
Synonyms: 8- {[benzyl(methyl)amino]methyl}- 7- hydroxy- 3- (3- methylphenoxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1cccc(c1)C)C(F)(F)F)Cc1ccccc1

STK547337
Synonyms: 5- ethyl- 5- methyl- 2- (pentylsulfanyl)- 3- phenyl- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC(c2c(=O)n1c1ccccc1)(C)CC

STK547338
Synonyms: N,11- bis(3- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)Cl)c1ccccc1

STK547339
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (5- chloro- 2- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N)Cl

STK547340
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- chlorophenyl)methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CNc1ccccc1)C(=O)N/N=C/c1ccccc1Cl

STK547341
Synonyms: 10- methyl- N- (4- methylphenyl)- 8- phenyl- 11- [4- (propan- 2- yl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)C(C)C)C)c1ccccc1

STK547343
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- methoxy- 4- [(2- methylbenzyl)oxy]phenyl}methylidene]- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Br)c(c(c1)OC)OCc1ccccc1C)CC

STK547344
Synonyms: N'- [(E)- (4- methoxy- 3- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}phenyl)methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: COc1ccc(cc1CSc1nnc(s1)C)/C=N/NC(=O)Cn1nc(cc1C)[N+](=O)[O-]

STK547345
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- chlorophenyl)methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccccc1Cl

STK547346
Synonyms: 2- amino- N- (2- methoxyphenyl)- 1- [2- (4- methoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1)CCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1OC

STK547348
Synonyms: butyl2- amino- 1- (4- chlorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)Cl

STK547349
Synonyms: 4- ({[6- tert- butyl- 3- cyano- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}methyl)benzoicacid
Smiles: N#Cc1c(SCc2ccc(cc2)C(=O)O)nc(cc1C(F)(F)F)C(C)(C)C

STK547350
Synonyms: 2- chloro- 5,6- dimethylpyridine- 3,4- dicarbonitrile
Smiles: N#Cc1c(C)c(C)nc(c1C#N)Cl

STK547352
Synonyms: 2- (biphenyl- 4- yl)- 1- [4- (diphenylmethyl)piperazin- 1- yl]ethanone
Smiles: O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)Cc1ccc(cc1)c1ccccc1

STK547353
Synonyms: 1- benzyl- N- hexyl- 2- [(phenylcarbonyl)amino]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c2nc3ccccc3nc2n(c1NC(=O)c1ccccc1)Cc1ccccc1

STK547354
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(2,4- dichlorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK547355
Synonyms: [3- amino- 4- (thiophen- 2- yl)- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]thieno[3,2- e]pyridin- 2- yl](thiophen- 2- yl)methanone
Smiles: O=C(c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCCC1)c1cccs1

STK547356
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3,4- dichlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl)C

STK547357
Synonyms: 2- methoxyethyl2- amino- 1- (4- ethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OCC

STK547358
Synonyms: 10- methyl- 11- (3- nitrophenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- ol
Smiles: Cc1nn(c2c1C(c1cccc(c1)[N+](=O)[O-])n1c(=N2)c(O)nc2c1cccc2)c1ccccc1

STK547359
Synonyms: 11- (3- chloro- 4- fluorophenyl)- 3- (2- methoxyethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)F

STK547360
Synonyms: 1- ethoxy- 3- (3- nitrophenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: CCOn1c(=O)c(c2cccc(c2)[N+](=O)[O-])[n+](c2c1cccc2)[O-]

STK547361
Synonyms: N,N'- bis(2- chloro- 5- methoxyphenyl)- 6- (piperidin- 1- yl)- 1,3,5- triazine- 2,4- diamine
Smiles: COc1ccc(c(c1)Nc1nc(nc(n1)N1CCCCC1)Nc1cc(OC)ccc1Cl)Cl

STK547362
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(4- chlorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK547363
Synonyms: 4- chloro- N- {[2- (pyridin- 3- ylcarbonyl)hydrazinyl]carbonothioyl}benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)Cl)NNC(=O)c1cccnc1

STK547364
Synonyms: N- (2,5- dimethylphenyl)- 11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cc(C)ccc1C)c1ccccc1

STK547365
Synonyms: 3- (butylsulfanyl)- 5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK547366
Synonyms: N'~1~,N'~7~- bis[(E)- (5- iodofuran- 2- yl)methylidene]heptanedihydrazide
Smiles: O=C(N/N=C/c1ccc(o1)I)CCCCCC(=O)N/N=C/c1ccc(o1)I

STK547367
Synonyms: 4- bromo- N- [5- (2- methoxyethyl)- 1,3,4- thiadiazol- 2- yl]benzamide
Smiles: COCCc1nnc(s1)NC(=O)c1ccc(cc1)Br

STK547368
Synonyms: 3- (4- ethylphenoxy)- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCc1ccc(cc1)Oc1c(=O)c2ccc(cc2oc1C(F)(F)F)O

STK547369
Synonyms: N- benzyl- 4- ethoxy- 6- methylpyrimidin- 2- amine
Smiles: CCOc1nc(NCc2ccccc2)nc(c1)C

STK547370
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- [(3- cyano- 6- methylpyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1sc2c(c1C#N)CCC2)C

STK547371
Synonyms: 3- [3- (2,4- dichlorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1Cl)Cl

STK547373
Synonyms: 4,4'- {[(2- phenylethyl)imino]dimethanediyl}bis(N,N- dimethylaniline)
Smiles: CN(c1ccc(cc1)CN(Cc1ccc(cc1)N(C)C)CCc1ccccc1)C

STK547375
Synonyms: ethyl4- cyano- 5- [({[3- cyano- 6- (thiophen- 2- yl)- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}acetyl)amino]- 3- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)c1cccs1

STK547376
Synonyms: 1- (4- bromophenyl)- 2- [(5- phenyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK547377
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- butoxyphenyl)methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK547378
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 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)c1ccncc1

STK547379
Synonyms: 10- (chloroacetyl)- 11- (3- fluorophenyl)- 3- (4- methoxyphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)F)C(=O)CCl

STK547380
Synonyms: 4- [(E)- {(2Z)- [amino(4- amino- 1,2,5- oxadiazol- 3- yl)methylidene]hydrazinylidene}methyl]- 2- methoxyphenyl2- methyl- 3- nitrobenzoate
Smiles: COc1cc(/C=N/N=C(/c2nonc2N)\N)ccc1OC(=O)c1cccc(c1C)[N+](=O)[O-]

STK547381
Synonyms: (8S,8aR,11aS)- 10- (2,4- dimethylphenyl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccccc2)N=Cc2c1cccc2

STK547382
Synonyms: 3- amino- N- (4- bromo- 2- methylphenyl)- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1ccc(cc1C)Br

STK547383
Synonyms: 2- (3,4- dichlorophenyl)- 3- (naphthalen- 1- yl)tetrahydro- 1H,5H- pyrazolo[1,2- a][1,2,4]triazol- 1- one
Smiles: O=C1N2CCCN2C(N1c1ccc(c(c1)Cl)Cl)c1cccc2c1cccc2

STK547384
Synonyms: 3- (4- chlorophenyl)- 11- (3- methoxyphenyl)- 10- (phenylcarbonyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: COc1cccc(c1)C1C2=C(CC(CC2=O)c2ccc(cc2)Cl)Nc2c(N1C(=O)c1ccccc1)cccc2

STK547385
Synonyms: 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 6- iodo- 3- (prop- 2- en- 1- yl)quinazolin- 4(3H)- one
Smiles: C=CCn1c(SC/C=C(/Cl)\C)nc2c(c1=O)cc(cc2)I

STK547386
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- [4- (butan- 2- yl)phenyl]acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N)C

STK547387
Synonyms: 2,6- dimethylphenyl2- methylbenzenesulfonate
Smiles: Cc1cccc(c1OS(=O)(=O)c1ccccc1C)C

STK547388
Synonyms: 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 6- iodo- 3- (2- methylphenyl)quinazolin- 4(3H)- one
Smiles: C/C(=C\CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I)/Cl

STK547390
Synonyms: N- {1- (3- methylbutyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: CC(CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C)C

STK547391
Synonyms: 3- [3- (3- chlorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1)Cl

STK547393
Synonyms: dibutyl[(2,4- dimethoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: CCCCOP(=O)(C(c1ccc(cc1OC)OC)Nc1ccccc1)OCCCC

STK547394
Synonyms: ethyl6- methyl- 2- [(pyrrolidin- 1- ylacetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCCC2)sc2c1CCC(C2)C

STK547395
Synonyms: N- (2,4- dimethoxyphenyl)- 11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2OC)c(nn1c1ccccc1)C

STK547397
Synonyms: 9- (heptylsulfanyl)- 8- (2- methylprop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK547398
Synonyms: prop- 2- en- 1- yl2- amino- 1- (4- butylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OCC=C

STK547400
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(E)- (2,4,6- trimethylphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(C)cc(cc1C)C)CC

STK547401
Synonyms: prop- 2- en- 1- yl2- amino- 1- [4- (ethoxycarbonyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)OCC

STK547402
Synonyms: diethyl[(2,4- dimethoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1OC)OC)Nc1ccccc1)OCC

STK547403
Synonyms: methyl4- (6- {[4- (ethoxycarbonyl)phenyl]amino}- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)c(nn1c1ccccc1)C

STK547404
Synonyms: 3- (3,4- dichlorophenyl)- 10- (3- methylbutanoyl)- 11- (4- methylphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(c(c2)Cl)Cl)Nc2c(N1C(=O)CC(C)C)cccc2

STK547405
Synonyms: ethyl2- ({[(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]carbamothioyl}amino)- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2ccccc2)sc2c1CCCCC2

STK547408
Synonyms: N,N- diethyl- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3)CC

STK547409
Synonyms: 1- ethoxy- 3- (4- phenoxyphenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: CCOn1c(=O)c(c2ccc(cc2)Oc2ccccc2)[n+](c2c1cccc2)[O-]

STK547410
Synonyms: 2- methoxyethyl2- amino- 1- (2- chlorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl

STK547411
Synonyms: 3- (biphenyl- 4- yloxy)- 7- hydroxy- 8- [(2- methylpiperidin- 1- yl)methyl]- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F

STK547412
Synonyms: 3- [3- (2- fluorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1F

STK547413
Synonyms: 2,5- bis(1H- benzotriazol- 1- yl)- 3,6- di(piperidin- 1- yl)cyclohexa- 2,5- diene- 1,4- dione
Smiles: O=C1C(=C(N2CCCCC2)C(=O)C(=C1N1CCCCC1)n1nnc2c1cccc2)n1nnc2c1cccc2

STK547414
Synonyms: 3- bromobenzylN'- cyano- N- prop- 2- en- 1- ylcarbamimidothioate
Smiles: C=CCN/C(=N/C#N)/SCc1cccc(c1)Br

STK547415
Synonyms: 2- [(3,4- dichlorophenyl)amino]- 4- methyl- N- phenyl- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(nc1C)Nc1ccc(c(c1)Cl)Cl)Nc1ccccc1

STK547416
Synonyms: 2- [4- methyl- 6- (2- methylpiperidin- 1- yl)pyrimidin- 2- yl]phenol
Smiles: CC1CCCCN1c1cc(C)nc(n1)c1ccccc1O

STK547417
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc3c(c2)cccc3)n(c2c1nc1ccccc1n2)CC1CCCO1

STK547418
Synonyms: ethyl{[3- cyclohexyl- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)C(C)C

STK547420
Synonyms: methyl5- chloro- 3- {[3- (3,4- dihydroisoquinolin- 2(1H)- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCc3c(C1)cccc3)cc(cc2)Cl

STK547421
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (4- butoxyphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)n2nnc3c2cccc3)c2ccccc2C=C1

STK547422
Synonyms: 1- ethyl- 2- imino- N- (3- methoxypropyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: COCCCNC(=O)c1cc2c(n(c1=N)CC)nc1n(c2=O)cccc1C

STK547426
Synonyms: 1- (4- bromophenyl)- 3- [(4- bromophenyl)amino]- 5- (4- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Brc1ccc(cc1)N1C(=O)C(=CC1c1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1)Br

STK547428
Synonyms: benzyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- {3- ethoxy- 4- [2- (morpholin- 4- yl)ethoxy]phenyl}- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOc1cc(ccc1OCCN1CCOCC1)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCc1ccccc1

STK547429
Synonyms: 6- iodo- 3- (4- methylphenyl)- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]quinazolin- 4(3H)- one
Smiles: CC(=C)CSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I

STK547431
Synonyms: N- [2- chloro- 5- (trifluoromethyl)phenyl]- 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nc2c(c1=O)cccc2

STK547432
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (2- nitrophenoxy)ethyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1[N+](=O)[O-]

STK547433
Synonyms: 2- {[6- (1,3- benzodioxol- 5- yl)- 3- cyanopyridin- 2- yl]sulfanyl}- N- (4- chloro- 2- fluorophenyl)acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1ccc(cc1F)Cl)c1ccc2c(c1)OCO2

STK547434
Synonyms: 3- {4- (4- bromophenyl)- 5- [(3- methoxybenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK547435
Synonyms: 7- ({2- [benzyl(methyl)amino]ethyl}amino)- 1- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CN(Cc1ccccc1)CCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK547437
Synonyms: 3- hydroxy- 1- (4- methoxyphenyl)- 5- (4- nitrophenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccccc1)O

STK547438
Synonyms: ethyl4- ({10- methyl- 8- phenyl- 11- [4- (propan- 2- yl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)C)c(nn1c1ccccc1)C

STK547440
Synonyms: 1- {(E)- [(1- methyl- 1H- benzimidazol- 2- yl)imino]methyl}- 3- nitro- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 2- ol
Smiles: [O-][N+](=O)c1cc2oc3c(c2c(c1O)/C=N/c1nc2c(n1C)cccc2)CCCC3

STK547441
Synonyms: [3- (4- {[(4- chlorophenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl][(4- chlorophenyl)sulfonyl]azanide
Smiles: Clc1ccc(cc1)C(=O)Nc1cc[n+](cc1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccc(cc1)Cl

STK547442
Synonyms: 3- [3- (4- fluorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)F

STK547444
Synonyms: [(4- methylphenyl)sulfonyl][3- (pyrrolidin- 1- yl)quinoxalin- 2- yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCCC1

STK547445
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 1- (4- fluorophenyl)- 3- hydroxy- 5- (4- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccc(cc1)Cl)O

STK547446
Synonyms: 5- (aminosulfanyl)- 2- methyl- 4- nitro- 1H- imidazole
Smiles: NSc1[nH]c(nc1[N+](=O)[O-])C

STK547447
Synonyms: N- ethyl- 2- imino- 5- oxo- 1- (2- phenylethyl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CCNC(=O)c1cc2c(n(c1=N)CCc1ccccc1)nc1n(c2=O)cccc1

STK547448
Synonyms: 4- nitrophenyl2- (4- methoxyphenyl)- 6- methylquinoline- 4- carboxylate
Smiles: COc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Oc1ccc(cc1)[N+](=O)[O-])C

STK547449
Synonyms: 3- [3- (3- methoxyphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1)OC

STK547451
Synonyms: N,N- dibutyl- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3)CCCC

STK547452
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- {(1E)- 1- [4- (naphthalen- 1- ylmethoxy)phenyl]ethylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/c1ccc(cc1)OCc1cccc2c1cccc2

STK547454
Synonyms: [8- (4- chlorophenyl)- 1,6- diphenyl- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7- dien- 3- yl](phenyl)methanone
Smiles: Clc1ccc(cc1)C1=NN(C2(CC1)SC(=NN2c1ccccc1)C(=O)c1ccccc1)c1ccccc1

STK547455
Synonyms: methyl6- amino- 5- cyano- 2- {[(3- cyano- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridin- 2- yl)sulfanyl]methyl}- 4- (2- fluorophenyl)- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(CSc2nc3CCCCCc3cc2C#N)OC(=C(C1c1ccccc1F)C#N)N

STK547456
Synonyms: 4- methoxy- N- (tricyclo[4.3.1.1~3,8~]undec- 3- ylmethyl)benzamide
Smiles: COc1ccc(cc1)C(=O)NCC12CCC3CC(C1)CC(C2)C3

STK547458
Synonyms: [(4- bromophenyl)sulfonyl][3- (1- butyl- 1H- imidazol- 3- ium- 3- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: CCCCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK547459
Synonyms: 3- {4- (4- bromophenyl)- 5- [(3,4- dichlorobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Brc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nnc1c1cccnc1

STK547460
Synonyms: N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 3- fluorobenzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2cccc(c2)F)/c2c1cccc2

STK547461
Synonyms: (3Z)- 5- methyl- 3- [2- (quinolin- 2- yl)hydrazinylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Cc1ccc2c(c1)/C(=N/Nc1ccc3c(n1)cccc3)/C(=O)N2

STK547462
Synonyms: 3- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 2- [({[(1E)- 1- phenylethylidene]amino}oxy)methyl]quinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)/C=N/n1c(CO/N=C(/c2ccccc2)\C)nc2c(c1=O)cccc2)O

STK547465
Synonyms: N- (4- phenylbutan- 2- yl)- 2- [(5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: CC(NC(=O)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1)CCc1ccccc1

STK547466
Synonyms: N- [3- (9H- carbazol- 9- yl)- 2- hydroxypropyl]- N- (2- iodophenyl)- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(c1ccccc1I)CC(Cn1c2ccccc2c2c1cccc2)O

STK547467
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (2- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1n1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547468
Synonyms: N- (2,4- dimethylphenyl)- 2- [(7- methyl- 4- oxo- 3- phenyl- 3,4,5,6,7,8- hexahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetamide
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCC(=O)Nc1ccc(cc1C)C)c1ccccc1

STK547469
Synonyms: methyl2- amino- 1- (furan- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccco1

STK547470
Synonyms: 3- ethyl6- methyl4- [(3,4- dichlorophenyl)amino]quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(c(c1)Cl)Cl)cc(cc2)C(=O)OC

STK547471
Synonyms: (8S,8aR,11aS)- 10- (1,3- benzodioxol- 5- yl)- N- (4- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3

STK547472
Synonyms: azepan- 1- yl[4- (5- phenyl- 1,3,4- oxadiazol- 2- yl)phenyl]methanone
Smiles: O=C(c1ccc(cc1)c1nnc(o1)c1ccccc1)N1CCCCCC1

STK547473
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccccc1c1nc2ccccc2c(n1)N1CCN(CC1)Cc1ccccc1

STK547474
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3- chloro- 4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK547475
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chloro- 6- fluorobenzyl)oxy]- 3- ethoxyphenyl}methylidene]- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN(CC)CC)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK547476
Synonyms: 4- bromo- N- [(5Z)- 4- oxo- 5- (pyridin- 3- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2cccnc2)/C1=O

STK547477
Synonyms: N,N- diethyl- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)CC

STK547481
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- ethoxy- 4- [(4- methylbenzyl)oxy]phenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)C)Br

STK547482
Synonyms: ethyl5- hydroxy- 2- [(phenylsulfanyl)methyl]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(CSc2ccccc2)oc2c1cc(O)cc2

STK547483
Synonyms: N'- [(E)- {3- ethoxy- 4- [(2- methylbenzyl)oxy]phenyl}methylidene]- 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]benzohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2ccc(cc2)Cn2nc(cc2C)[N+](=O)[O-])ccc1OCc1ccccc1C

STK547484
Synonyms: 2- imino- 1,10- dimethyl- 5- oxo- N- (tetrahydrofuran- 2- ylmethyl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)NCC1CCCO1

STK547485
Synonyms: 1- butyl- 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 5- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCN1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccc(cc1)C)O

STK547487
Synonyms: 3- (2- chlorophenyl)- 5- imino- 1,7- dimethyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccccc1Cl)(C(C2(C#N)C#N)C)C

STK547488
Synonyms: methyl4- [3- (4- methylphenyl)- 1- oxo- 10- (phenylacetyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 11- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(Nc3c(N1C(=O)Cc1ccccc1)cccc3)CC(CC2=O)c1ccc(cc1)C

STK547489
Synonyms: 2,6- dimethoxy- N- {[2- (quinolin- 2- ylcarbonyl)hydrazinyl]carbonothioyl}benzamide
Smiles: COc1cccc(c1C(=O)NC(=S)NNC(=O)c1ccc2c(n1)cccc2)OC

STK547491
Synonyms: 3- (4- bromophenyl)- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Brc1ccc(cc1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK547492
Synonyms: 2- [chloro(difluoro)methyl]- 6- methoxy- 4- oxo- 1,4- dihydroquinoline- 3- carbonitrile
Smiles: N#Cc1c(=O)c2cc(OC)ccc2[nH]c1C(Cl)(F)F

STK547493
Synonyms: 2- amino- 6- ethyl- 5- methyl- 4,4- bis(trifluoromethyl)- 1- [4- (trifluoromethyl)phenyl]- 1,4- dihydropyridine- 3- carbonitrile
Smiles: CCC1=C(C)C(C(=C(N1c1ccc(cc1)C(F)(F)F)N)C#N)(C(F)(F)F)C(F)(F)F

STK547494
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(1E)- 1- [4- (2- methylpropyl)phenyl]ethylidene}- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC(Cc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N)/C)C

STK547495
Synonyms: dibutyl[(2,4- dichlorophenyl)(phenylamino)methyl]phosphonate
Smiles: CCCCOP(=O)(C(c1ccc(cc1Cl)Cl)Nc1ccccc1)OCCCC

STK547496
Synonyms: 3- amino- N- (4- chlorophenyl)- 4- (thiophen- 2- yl)- 6,7- dihydro- 5H- cyclopenta[b]thieno[3,2- e]pyridine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCC1

STK547497
Synonyms: 2- amino- 1- (3,5- dichlorophenyl)- N- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cc(Cl)cc(c1)Cl

STK547498
Synonyms: 3- {4- (4- ethoxyphenyl)- 5- [(3- fluorobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2cccc(c2)F)nnc1c1cccnc1

STK547499
Synonyms: 3- (2- methylphenyl)- 2- (pentylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3

STK547500
Synonyms: 4- amino- N'- [(E)- pyridin- 4- ylmethylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: N/C(=N\N=C\c1ccncc1)/c1nonc1N

STK547501
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- chlorophenyl)carbonyl]- 8- (naphthalen- 2- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2[C@H]2N1c1ccccc1C=C2)c1ccc2c(c1)cccc2

STK547502
Synonyms: 4- [11- (2- chlorophenyl)- 3- (4- methoxyphenyl)- 1- oxo- 1,2,3,4,5,11- hexahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccccc1Cl)C(=O)CCC(=O)O

STK547503
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3- methylbutyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC(C)C

STK547505
Synonyms: 11- (4- butylphenyl)- 3- (tetrahydrofuran- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)CC1CCCO1

STK547506
Synonyms: ethyl4- (2- butyl- 4- oxoquinazolin- 3(4H)- yl)benzoate
Smiles: CCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)C(=O)OCC

STK547507
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK547508
Synonyms: (8S,8aR,11aS)- 10- (4- chlorophenyl)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)cccc3

STK547509
Synonyms: 7- tert- butyl- 3- (3- methylphenyl)- 2- (prop- 2- en- 1- ylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC(C3)C(C)(C)C

STK547510
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK547511
Synonyms: N- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]- 10- oxo- 9,10- dihydroanthracene- 9- carboxamide
Smiles: O=C(C1c2ccccc2C(=O)c2c1cccc2)Nc1scc(n1)c1ccc(cc1)F

STK547513
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)ccc1OCc1ccccc1Cl

STK547514
Synonyms: 4- amino- N'- {(E)- [3- methoxy- 4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: COc1cc(/C=N/N=C(\c2nonc2N)/N)ccc1OCc1cccc2c1cccc2

STK547515
Synonyms: 4- [(1E)- 1- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)ethyl]- 2- methoxyphenyl4- chlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C(=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/C

STK547516
Synonyms: prop- 2- en- 1- yl2- amino- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC1=CCCCC1

STK547517
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(E)- (4- ethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(CC)CC)c1nonc1N

STK547518
Synonyms: N- [(3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)carbamothioyl]- 5- methyl- 3- phenyl- 1,2- oxazole- 4- carboxamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2c(C)onc2c2ccccc2)sc2c1CCCC2

STK547519
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC)C

STK547520
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (4- tert- butylphenyl)methylidene]acetohydrazide
Smiles: O=C(N/N=C/c1ccc(cc1)C(C)(C)C)CSc1nnc(s1)SCc1ccccc1

STK547521
Synonyms: (5E)- 1- butyl- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCN1C(=O)NC(=O)/C(=C\NCCCn2ccnc2)/C1=O

STK547523
Synonyms: propan- 2- yl2- amino- 1- (1,3- benzodioxol- 5- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2)C

STK547524
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (dimethylamino)- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N(C)C)/C(=O)N1Cc1ccc2c(c1)OCO2

STK547526
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (naphthalen- 1- yl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)C(=O)c1ccccc1

STK547527
Synonyms: 3- butyl- 2- [(4- chlorobenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547529
Synonyms: methyl6- amino- 5- cyano- 2- {[(3- cyano- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridin- 2- yl)sulfanyl]methyl}- 4- (2- fluoro- 5- methoxyphenyl)- 4H- pyran- 3- carboxylate
Smiles: COc1ccc(c(c1)C1C(=C(CSc2nc3CCCCCc3cc2C#N)OC(=C1C#N)N)C(=O)OC)F

STK547530
Synonyms: (8S,8aR,11aS)- 10- (2,4- dimethylphenyl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547531
Synonyms: 2- imino- 10- (2- methoxyphenyl)tetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1ccccc1OC)C(C2(C#N)C#N)CCCC3

STK547532
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (2- methyl- 4- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK547533
Synonyms: 5- (4- chlorophenyl)- 4- [4- (2- chlorophenyl)piperazin- 1- yl]thieno[2,3- d]pyrimidine
Smiles: Clc1ccc(cc1)c1csc2c1c(ncn2)N1CCN(CC1)c1ccccc1Cl

STK547534
Synonyms: 3- chloro- 4- [(4- methoxyphenyl)amino]- 1- (2- phenylethyl)- 1H- pyrrole- 2,5- dione
Smiles: COc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)CCc1ccccc1

STK547535
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [4- (4- methoxybenzyl)piperazin- 1- yl]propan- 2- ol
Smiles: COc1ccc(cc1)CN1CCN(CC1)CC(Cn1c2ccccc2c2c1cccc2)O

STK547536
Synonyms: [3- (1- benzyl- 1H- imidazol- 3- ium- 3- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl][(4- bromophenyl)sulfonyl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccn(c2)Cc2ccccc2)C(=O)c2c(C1=O)cccc2

STK547537
Synonyms: N'- {(E)- [1- (4- fluorophenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK547538
Synonyms: (5Z)- 5- (4- fluorobenzylidene)- 2- [(3- methylphenyl)amino]- 1,3- thiazol- 4(5H)- one
Smiles: Fc1ccc(cc1)/C=C/1\SC(=NC1=O)Nc1cccc(c1)C

STK547540
Synonyms: 4- amino- N'- [(E)- {2- [(4- bromobenzyl)oxy]- 5- nitrophenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: Brc1ccc(cc1)COc1ccc(cc1/C=N/N=C(/c1nonc1N)\N)[N+](=O)[O-]

STK547541
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547542
Synonyms: 2- imino- 10- (3,4,5- trimethoxyphenyl)tetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1cc(OC)c(c(c1)OC)OC)C(C2(C#N)C#N)CCCC3

STK547544
Synonyms: [(4- chlorophenyl)sulfonyl][3- (3,5- dimethylpiperidin- 1- yl)quinoxalin- 2- yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CC(C)CC(C1)C

STK547546
Synonyms: N- {1- [1- (4- tert- butyl- 2,6- dimethylbenzyl)- 1H- benzimidazol- 2- yl]- 3- (methylsulfanyl)propyl}- 4- fluorobenzamide
Smiles: CSCCC(c1nc2c(n1Cc1c(C)cc(cc1C)C(C)(C)C)cccc2)NC(=O)c1ccc(cc1)F

STK547547
Synonyms: 7,8- dimethoxy- 2- [6- (4- methoxyphenoxy)hexyl]phthalazin- 1(2H)- one
Smiles: COc1ccc(cc1)OCCCCCCn1ncc2c(c1=O)c(OC)c(cc2)OC

STK547549
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (2- methoxybenzyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)NCc2ccccc2OC)c(c(c1)c1cccs1)C#N

STK547550
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (2,4- dichlorophenyl)acetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)Nc1ccc(cc1Cl)Cl

STK547551
Synonyms: 1- [4- (naphthalen- 1- ylmethyl)piperazin- 1- yl]- 3- (trifluoromethyl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c2nc3c(n2c(cc1C(F)(F)F)N1CCN(CC1)Cc1cccc2c1cccc2)cccc3

STK547553
Synonyms: 3- butyl- 2- [(2,4- dichlorobenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547554
Synonyms: 3- hydroxy- 5- (4- hydroxy- 3- methoxyphenyl)- 1- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1O)C1C(=C(C(=O)N1c1ccccc1)O)C(=O)c1ccccc1

STK547555
Synonyms: 2- (2,6- dichlorophenyl)- 1H- phenanthro[9,10- d]imidazole
Smiles: Clc1cccc(c1c1nc2c([nH]1)c1ccccc1c1c2cccc1)Cl

STK547556
Synonyms: N- (naphthalen- 1- yl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547557
Synonyms: N- [3- (3,4- dimethoxyphenyl)propyl]- N- [1- (4- ethylphenyl)- 2,5- dioxopyrrolidin- 3- yl]acetamide
Smiles: CCc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)C)CCCc1ccc(c(c1)OC)OC

STK547558
Synonyms: N- (3,5- dimethylphenyl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1cc(cc(c1OC)OC)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)cc(c1)C)nc1c2cccc1

STK547559
Synonyms: 2- (hexylsulfanyl)- 6- iodo- 3- (4- methylphenyl)quinazolin- 4(3H)- one
Smiles: CCCCCCSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I

STK547562
Synonyms: 3- (4- methoxyphenyl)- 5- (3- nitrophenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK547563
Synonyms: 7- {[2- (3,4- dihydroisoquinolin- 2(1H)- yl)ethyl]amino}- 2- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCc2c(C1)cccc2

STK547564
Synonyms: 3- (4- benzylpiperazin- 1- yl)- 4- chloro- 1- (2- chlorophenyl)- 1H- pyrrole- 2,5- dione
Smiles: ClC1=C(N2CCN(CC2)Cc2ccccc2)C(=O)N(C1=O)c1ccccc1Cl

STK547565
Synonyms: N- [4- ({(E)- [1- (4- methoxyphenyl)- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}amino)phenyl]acetamide
Smiles: COc1ccc(cc1)N1C(=S)NC(=O)/C(=C\Nc2ccc(cc2)NC(=O)C)/C1=O

STK547566
Synonyms: S- (2- {[(2- methoxyphenyl)carbonyl]amino}phenyl)2- methoxybenzenecarbothioate
Smiles: COc1ccccc1C(=O)Nc1ccccc1SC(=O)c1ccccc1OC

STK547567
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (4- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccccc1

STK547569
Synonyms: N- (diphenylmethyl)- 2- {[3- (4- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3

STK547570
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (2- chlorobenzyl)acetamide
Smiles: N#Cc1c(SCC(=O)NCc2ccccc2Cl)nc(c(c1c1cccs1)C#N)N

STK547571
Synonyms: 2- (2,5- dimethoxyphenyl)- 10- iminotetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1cc(OC)ccc1OC)C(C2(C#N)C#N)CCCC3

STK547575
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1C)c1nonc1N)N/N=C/c1ccc(cc1)C(C)C

STK547576
Synonyms: 7- {[2- (4- phenylpiperazin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3ccccc3oc1cc2NCCN1CCN(CC1)c1ccccc1

STK547577
Synonyms: 2- amino- 1- [2- (4- methoxyphenyl)ethyl]- N- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)OC

STK547578
Synonyms: N- [2- (2- amino- 4,4- dimethyl- 6- oxocyclohex- 1- en- 1- yl)- 1,1,1,3,3,3- hexafluoropropan- 2- yl]- 3- chlorobenzamide
Smiles: Clc1cccc(c1)C(=O)NC(C(F)(F)F)(C(F)(F)F)C1=C(N)CC(CC1=O)(C)C

STK547579
Synonyms: 1- (4- chlorophenyl)- 5- (3,4- dimethoxyphenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1OC)C1N(c2ccc(cc2)Cl)C(=O)C(=C1C(=O)c1ccccc1)O

STK547580
Synonyms: methyl5- ({4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 2- ethoxyphenoxy}methyl)furan- 2- carboxylate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1ccc(o1)C(=O)OC

STK547583
Synonyms: 2- methylpropyl{6- [(2- methoxyphenyl)carbamoyl]- 5- methyl- 4- oxothieno[2,3- d]pyrimidin- 3(4H)- yl}acetate
Smiles: COc1ccccc1NC(=O)c1sc2c(c1C)c(=O)n(cn2)CC(=O)OCC(C)C

STK547584
Synonyms: N- {2- [2- amino- 3- (phenylsulfonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl]ethyl}- 2- chlorobenzamide
Smiles: O=C(c1ccccc1Cl)NCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccccc1

STK547585
Synonyms: 2- methoxyethyl2- amino- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)CCCOC

STK547586
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- bromo- 5- ethoxy- 4- hydroxyphenyl)methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1O)Br

STK547587
Synonyms: ethyl5- methoxy- 3- {[(4- methyl- 1,2,5- oxadiazol- 3- yl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1nonc1C)cc(cc2)OC

STK547589
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3- fluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cccc(c2)F)c(c(c1)c1cccs1)C#N

STK547590
Synonyms: 2- methoxyethyl2- amino- 1- (3- chlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)Cl

STK547591
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1ccc(cc1)F

STK547592
Synonyms: (2E)- 3- (5- bromofuran- 2- yl)prop- 2- enoicacid
Smiles: OC(=O)/C=C/c1ccc(o1)Br

STK547593
Synonyms: methyl5- chloro- 3- ({3- [4- (2- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)Cl

STK547595
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (morpholin- 4- ylmethyl)- N'- {(E)- [3- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1cccc(c1)OCc1cccc2c1cccc2

STK547596
Synonyms: 3- amino- N- benzyl- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccccc1

STK547597
Synonyms: (8S,8aR,11aS)- 10- (naphthalen- 1- yl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3)c1cccc(c1)[N+](=O)[O-]

STK547598
Synonyms: 2- amino- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- N- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC1=CCCCC1

STK547599
Synonyms: 2- imino- N- (2- methoxyethyl)- 1,10- dimethyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C

STK547600
Synonyms: 1- benzyl- 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)Cc1ccccc1

STK547602
Synonyms: N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccc(cc1)N(C)C

STK547603
Synonyms: 2- cyano- 2- [3- (morpholin- 4- yl)quinoxalin- 2- yl]- N- (1- phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCOCC1)C(=O)NC(c1ccccc1)C

STK547604
Synonyms: 2- (4- chlorophenyl)- 3- {2- [2- (2- iodophenoxy)ethoxy]ethyl}quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccccc1I

STK547605
Synonyms: 1- [(2,6- difluorobenzyl)oxy]- 3- (4- fluorophenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: Fc1ccc(cc1)c1c(=O)n(OCc2c(F)cccc2F)c2c([n+]1[O-])cccc2

STK547606
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)cccc2

STK547607
Synonyms: 1- (4- bromophenyl)- 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547608
Synonyms: 3- (4- bromophenyl)- 2- [(E)- 2- (4- bromophenyl)ethenyl]- 6- iodoquinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1ccc(cc1)Br)I

STK547609
Synonyms: N- tert- butyl- 6- nitro- 1,3- benzoxazol- 2- amine
Smiles: [O-][N+](=O)c1ccc2c(c1)oc(n2)NC(C)(C)C

STK547610
Synonyms: N'- [(E)- (2- hydroxy- 3,5- diiodophenyl)methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: Ic1cc(/C=N/NC(=O)Cn2nc(cc2C)[N+](=O)[O-])c(c(c1)I)O

STK547611
Synonyms: N- (4- bromophenyl)- 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547613
Synonyms: 3- amino- N- phenyl- 4- (thiophen- 2- yl)- 6,7- dihydro- 5H- cyclopenta[b]thieno[3,2- e]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c(c1cccs1)c1c(n2)CCC1)Nc1ccccc1

STK547614
Synonyms: ethyl5- methyl- 3- ({[3- (trifluoromethyl)phenyl]carbonyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C(F)(F)F)cc(cc2)C

STK547616
Synonyms: N- {1- (3- methoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C

STK547617
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (4- chlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)Cl)C=Cc1c2cccc1

STK547618
Synonyms: 3- (4- phenylpiperazin- 1- yl)- N- [2- (trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CCN1CCN(CC1)c1ccccc1

STK547619
Synonyms: ethyl4- (3- {1- cyano- 2- oxo- 2- [(1- phenylethyl)amino]ethyl}quinoxalin- 2- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2ccccc2nc1C(C(=O)NC(c1ccccc1)C)C#N

STK547620
Synonyms: dipropan- 2- yl[(benzylamino)(4- methoxyphenyl)methyl]phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(OC(C)C)OC(C)C)NCc1ccccc1

STK547621
Synonyms: 5- (1,3- benzodioxol- 5- ylamino)- 3,3- dimethyl- 5- oxopentanoicacid
Smiles: O=C(CC(CC(=O)O)(C)C)Nc1ccc2c(c1)OCO2

STK547623
Synonyms: 4- [5- (2,5- dimethoxyphenyl)- 3- (4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cc(OC)ccc1OC)C(=O)CCC(=O)O

STK547624
Synonyms: ethyl1- (2- nitrophenyl)- 6- phenyl- 8- [4- (propan- 2- yl)phenyl]- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7,9- triene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)C=CC(=NN2c1ccccc1)c1ccc(cc1)C(C)C)c1ccccc1[N+](=O)[O-]

STK547625
Synonyms: ethyl4- cyano- 5- [({[3- cyano- 4- methyl- 6- (trifluoromethyl)pyridin- 2- yl]sulfanyl}acetyl)amino]- 3- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc(cc(c1C#N)C)C(F)(F)F

STK547626
Synonyms: methyl(2E)- 3- (3,4- diethoxyphenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoate
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)OC)/NC(=O)c1ccccc1

STK547627
Synonyms: methyl5- (4- chloro- 3- nitrophenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: COC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK547628
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3)CCC

STK547629
Synonyms: (8S,8aR,11aS)- 10- (4- methylphenyl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547630
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (benzyloxy)phenyl]methylidene}- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)OCc1ccccc1

STK547631
Synonyms: N- (2,4- dimethylphenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1C)C)nc1c2cccc1

STK547632
Synonyms: 11- (4- tert- butylphenyl)- 10- (cyclopropylcarbonyl)- 3- (4- methoxyphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)C(C)(C)C)C(=O)C1CC1

STK547633
Synonyms: methyl(1R,2R,3R,3aS)- 3- cyano- 2- [4- (dimethylamino)phenyl]- 1- (phenylcarbonyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccc(cc2)N(C)C)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK547634
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(2,6- dichlorobenzyl)oxy]- 5- nitrophenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(ccc1OCc1c(Cl)cccc1Cl)[N+](=O)[O-]

STK547636
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- methoxy- 4- [(3- methylbenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1cccc(c1)C)Br

STK547637
Synonyms: N,N- dibutyl- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3)CCCC

STK547638
Synonyms: 2- butyl- 3- methyl- 1- [4- (pyridin- 2- yl)piperazin- 1- yl]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1ccccn1)c1ccccc1n2

STK547639
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (3- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)cccc3

STK547641
Synonyms: 1- (3- {[(4- chlorophenyl)sulfonyl](cyano)methyl}quinoxalin- 2- yl)piperidine- 4- carboxamide
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCC(CC1)C(=O)N

STK547642
Synonyms: (4bS,7aR,8S)- 8- (phenylcarbonyl)- 6- [3- (trifluoromethyl)phenyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@H]2[C@@H]1[C@H](N1C2C=CC=N1)C(=O)c1ccccc1

STK547643
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2,4- dichlorobenzyl)oxy]phenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK547644
Synonyms: 1- (2,6- dimethylpiperidin- 1- yl)- 3- [2- (prop- 2- en- 1- yl)phenoxy]propan- 2- ol
Smiles: C=CCc1ccccc1OCC(CN1C(C)CCCC1C)O

STK547645
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(3- methylbenzyl)oxy]phenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK547646
Synonyms: 4- amino- N'- {(E)- [5- (2- methyl- 3- nitrophenyl)furan- 2- yl]methylidene}- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: [O-][N+](=O)c1cccc(c1C)c1ccc(o1)/C=N/N=C(\c1nonc1N)/N

STK547647
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2- methoxy- 5- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2)[N+](=O)[O-]

STK547650
Synonyms: (1'R,2'R)- 2'- (3,4- dimethoxyphenyl)- 1'- [(4- methoxyphenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(c(c1)OC)OC)C(=O)c1c(C2=O)cccc1

STK547651
Synonyms: 6- hydroxy- 3- phenyl- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Oc1[nH]c(=S)n(c(=O)c1C1NCCc2c1cccc2)c1ccccc1

STK547653
Synonyms: 2- [(3,4- dichlorobenzyl)sulfanyl]- 3- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)cccc2

STK547654
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(1E)- 1- (3- methoxyphenyl)ethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)OC)\C)CC

STK547655
Synonyms: methyl(1R,2S,3S)- 3- [(4- chlorophenyl)carbamoyl]- 1- cyano- 2- (furan- 2- yl)- 1,2,3,10b- tetrahydropyrrolo[2,1- a]isoquinoline- 1- carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@H](c2ccco2)[C@H](N2C1c1ccccc1C=C2)C(=O)Nc1ccc(cc1)Cl

STK547656
Synonyms: N- [4- (dimethylamino)phenyl]- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1ccc(co1)C(=O)Nc1ccc(cc1)N(C)C

STK547657
Synonyms: (8S,8aR,11aS)- 10- (3- fluorophenyl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547658
Synonyms: 4- (hexyloxy)- N- [(E)- {4- [(4- methyl- 3,6- dihydro- 2H- pyran- 3- yl)oxy]phenyl}methylidene]aniline
Smiles: CCCCCCOc1ccc(cc1)/N=C/c1ccc(cc1)OC1COCC=C1C

STK547659
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- ethylphenyl)methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK547660
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- phenoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nnc1c1cccnc1

STK547661
Synonyms: 11- benzyl- 3- (4- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK547662
Synonyms: 2- (diethylamino)- 6- phenylpyrimidine- 4- carboxamide
Smiles: CCN(c1nc(cc(n1)c1ccccc1)C(=O)N)CC

STK547663
Synonyms: N,N- dibutyl- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3)CCCC

STK547666
Synonyms: 3- (4- benzylpiperazin- 1- yl)- 4- chloro- 1- (4- iodophenyl)- 1H- pyrrole- 2,5- dione
Smiles: Ic1ccc(cc1)N1C(=O)C(=C(C1=O)Cl)N1CCN(CC1)Cc1ccccc1

STK547667
Synonyms: 2- [3- (benzylsulfanyl)- 1H- 1,2,4- triazol- 1- yl]- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)Cn1cnc(n1)SCc1ccccc1

STK547668
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- [(E)- (2- fluorophenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN1CCc2c1cccc2)C(=O)N/N=C/c1ccccc1F

STK547669
Synonyms: 3- [2- (4- chloro- 3- methylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(c(c1)C)Cl

STK547670
Synonyms: ethyl4- [11- (3,4- dimethylphenyl)- 4- oxo- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)C)C

STK547671
Synonyms: methyl4- ({[(4- oxo- 3,4- dihydroquinazolin- 2- yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccccc2c(=O)[nH]1

STK547673
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1C)c1nonc1N)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK547674
Synonyms: 3- butyl- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCC(=O)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547676
Synonyms: N'- [(E)- (5- methylfuran- 2- yl)methylidene]- 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]benzohydrazide
Smiles: Cc1ccc(o1)/C=N/NC(=O)c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-]

STK547677
Synonyms: ethyl[(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetate
Smiles: CCCCn1c(SCC(=O)OCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547678
Synonyms: (6aS,6bR,9aS,10R)- 8- (4- acetylphenyl)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)C(=O)C)C=Cc1c2cccc1

STK547679
Synonyms: 3- (4- chlorophenyl)- 1- [(4- chlorophenyl)sulfonyl]- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazole
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)S(=O)(=O)c1ccc(cc1)Cl

STK547680
Synonyms: 5- bromo- 1- (2- fluorobenzyl)- 3- nitro- 1H- 1,2,4- triazole
Smiles: Fc1ccccc1Cn1nc(nc1Br)[N+](=O)[O-]

STK547681
Synonyms: 3- [3- (4- ethylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCc1ccc(cc1)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547682
Synonyms: N- [(1E)- 3- {[3- (dimethylamino)propyl]amino}- 1- (4- methoxyphenyl)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: COc1ccc(cc1)/C=C(\C(=O)NCCCN(C)C)/NC(=O)c1ccccc1

STK547683
Synonyms: N,N'- bis[3- (dimethylamino)propyl]- 9H- fluorene- 2,7- disulfonamide
Smiles: CN(CCCNS(=O)(=O)c1ccc2c(c1)Cc1c2ccc(c1)S(=O)(=O)NCCCN(C)C)C

STK547686
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chloro- 6- fluorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCN(CC2)C)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK547687
Synonyms: prop- 2- en- 1- yl2- amino- 1- (4- bromophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Br

STK547688
Synonyms: 3- [2- (2- tert- butyl- 6- methylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)cccc1C(C)(C)C

STK547689
Synonyms: 3- chloro- N- {1- [1- (2,6- dichlorobenzyl)- 1H- benzimidazol- 2- yl]ethyl}benzamide
Smiles: Clc1cccc(c1)C(=O)NC(c1nc2c(n1Cc1c(Cl)cccc1Cl)cccc2)C

STK547690
Synonyms: N- (4- {3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 5- (4- nitrophenyl)- 2- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}phenyl)acetamide
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)NC(=O)C

STK547691
Synonyms: N- (2,4- dichlorophenyl)- 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547692
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- [(1E)- 1- (2,4- dihydroxyphenyl)ethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Oc1ccc(c(c1)O)/C(=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/C

STK547694
Synonyms: 1- (9H- carbazol- 9- yl)- 3- (dibutylamino)propan- 2- ol
Smiles: CCCCN(CC(Cn1c2ccccc2c2c1cccc2)O)CCCC

STK547695
Synonyms: 2- ethyl- 4- (heptylsulfanyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCCCCSc1nc(CC)nc2c1c1CC(C)(C)OCc1s2

STK547696
Synonyms: 9- (4- chlorophenyl)- 7- (4- methoxyphenyl)- 5,7- dihydro- 6H- benzo[h][1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)c1c(CC2)cccc1

STK547697
Synonyms: propan- 2- yl2- amino- 1- benzyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1)C

STK547698
Synonyms: 4- fluoro- N- (2- {[(2E)- 2- {[5- (2- methyl- 3- nitrophenyl)furan- 2- yl]methylidene}hydrazinyl]carbonyl}phenyl)benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1ccccc1C(=O)N/N=C/c1ccc(o1)c1cccc(c1C)[N+](=O)[O-]

STK547699
Synonyms: 5- bromo- 1- (but- 2- yn- 1- yl)- 3- nitro- 1H- 1,2,4- triazole
Smiles: [O-][N+](=O)c1nn(c(n1)Br)CC#CC

STK547700
Synonyms: 2- [(1,3- dioxolan- 2- ylmethyl)(methyl)amino]- 1- (8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: CN(CC(=O)N1CCc2c(C1)c1cc(F)ccc1[nH]2)CC1OCCO1