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

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STK526458
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (4- iodo- 2- methylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2C)I)nc(cc1c1ccc(cc1)Cl)c1cccs1

STK526459
Synonyms: 2,2- dimethyl- 5- phenyl- 8- (piperidin- 1- yl)- 2,3- dihydro- 1H- pyrano[3'',2'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC1(C)COc2c(C1)c1c(nc2c2ccccc2)sc2c1ncnc2N1CCCCC1

STK526460
Synonyms: 7- ethyl- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydro- 3H- pyrazolo[3,4- c][2,7]naphthyridin- 1- amine
Smiles: CCN1CCc2c(C1)c(nc1c2c(N)n[nH]1)N1CCOCC1

STK526462
Synonyms: 2- [(2- methylacryloyl)oxy]ethyl6- amino- 4- (2- chloro- 5- nitrophenyl)- 5- cyano- 2- methyl- 4H- pyran- 3- carboxylate
Smiles: [O-][N+](=O)c1cc(C2C(=C(C)OC(=C2C#N)N)C(=O)OCCOC(=O)C(=C)C)c(cc1)Cl

STK526463
Synonyms: ethyl2- [(prop- 2- en- 1- ylcarbamothioyl)amino]- 5,6,7,8- tetrahydroquinoline- 3- carboxylate
Smiles: C=CCNC(=S)Nc1nc2CCCCc2cc1C(=O)OCC

STK526464
Synonyms: 2- [(dichloroacetyl)amino]- 3- hydroxy- 3- (4- nitrophenyl)propylpyridin- 3- ylcarbamate
Smiles: O=C(Nc1cccnc1)OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl

STK526465
Synonyms: (2S,3R,10bS)- 3- (2,2- dimethylpropanoyl)- 2- (thiophen- 3- yl)- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H]2c3ccccc3C=CN2[C@H]([C@@H]1c1ccsc1)C(=O)C(C)(C)C

STK526466
Synonyms: ethyl6- amino- 4- [4- (benzyloxy)phenyl]- 2- (chloromethyl)- 5- cyano- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(CCl)OC(=C(C1c1ccc(cc1)OCc1ccccc1)C#N)N

STK526467
Synonyms: 2- {[4- (4- fluorophenyl)- 4- oxobutyl]sulfanyl}- 4- (4- methoxyphenyl)- 6- (thiophen- 2- yl)pyridine- 3- carbonitrile
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SCCCC(=O)c1ccc(cc1)F)c1cccs1

STK526470
Synonyms: 3- benzyl- 2- (ethylsulfanyl)- 6,7,8,9- tetrahydropyrimido[4,5- b]quinolin- 4(3H)- one
Smiles: CCSc1nc2nc3CCCCc3cc2c(=O)n1Cc1ccccc1

STK526472
Synonyms: N- tert- butyl- 2- {[5- butyl- 4- hydroxy- 1- (4- methylphenyl)- 6- oxo- 1,6- dihydropyrimidin- 2- yl]sulfanyl}acetamide
Smiles: CCCCc1c(O)nc(n(c1=O)c1ccc(cc1)C)SCC(=O)NC(C)(C)C

STK526473
Synonyms: 4,4',4''- (methanetriyltrisulfanediyl)tris(2,6- di- tert- butylphenol)
Smiles: CC(c1cc(SC(Sc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)Sc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)cc(c1O)C(C)(C)C)(C)C

STK526474
Synonyms: N- butyl- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- amine
Smiles: CCCCNc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK526476
Synonyms: N'- [(E)- {4- [bis(2- chloroethyl)amino]phenyl}methylidene]- 2- {[6- methyl- 2- (methylsulfanyl)pyrimidin- 4- yl]sulfanyl}acetohydrazide
Smiles: ClCCN(c1ccc(cc1)/C=N/NC(=O)CSc1cc(C)nc(n1)SC)CCCl

STK526478
Synonyms: 7- benzyl- 3- (piperidin- 1- yl)- 1- (prop- 2- en- 1- ylamino)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: C=CCNc1nc(N2CCCCC2)c(c2c1CN(CC2)Cc1ccccc1)C#N

STK526479
Synonyms: 3- (3- chlorophenyl)- 1- [3- (3- chlorophenyl)- 1- {5- [(2Z)- 2- (4- fluorobenzylidene)hydrazinyl]- 5- oxopentyl}- 5,5- dimethyl- 2- oxoimidazolidin- 4- yl]- 1- hydroxyurea
Smiles: O=C(N/N=C\c1ccc(cc1)F)CCCCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1cccc(c1)Cl)O)c1cccc(c1)Cl

STK526480
Synonyms: 2- [3- (morpholin- 4- yl)- 3- oxopropyl]- 2,3- dihydrophthalazine- 1,4- dione
Smiles: O=C(N1CCOCC1)CCn1[nH]c(=O)c2c(c1=O)cccc2

STK526481
Synonyms: 2- imino- 1- (4- nitrophenyl)- 2,5- dihydro- 1H- pyrido[3,2- b]indole- 3- carbonitrile
Smiles: N#Cc1cc2[nH]c3c(c2n(c1=N)c1ccc(cc1)[N+](=O)[O-])cccc3

STK526482
Synonyms: ethyl(2Z)- 5- amino- 2- [2- (benzyloxy)benzylidene]- 7- [3- (benzyloxy)phenyl]- 6- cyano- 3- oxo- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyridine- 8- carboxylate
Smiles: CCOC(=O)C1=c2s/c(=C\c3ccccc3OCc3ccccc3)/c(=O)n2C(=C(C1c1cccc(c1)OCc1ccccc1)C#N)N

STK526483
Synonyms: N- (2,4,6- trihydroxypyrimidin- 5- yl)acetamide
Smiles: CC(=O)Nc1c(O)nc(nc1O)O

STK526485
Synonyms: 5- ethyl- 2,2- dimethyl- N,N- dipropyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- amine
Smiles: CCCN(c1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC)CCC

STK526489
Synonyms: propyl4- {(5E)- 4- oxo- 5- [4- oxo- 3- (4- oxo- 4- propoxybutyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}butanoate
Smiles: CCCOC(=O)CCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCC(=O)OCCC)/C1=O

STK526490
Synonyms: 6- (4- acetylpiperazin- 1- yl)- 8- butyl- 3,3- dimethyl- 3,4- dihydro- 1H- thiopyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCCCc1nc(N2CCN(CC2)C(=O)C)c(c2c1CSC(C2)(C)C)C#N

STK526491
Synonyms: N- (2- butyl- 6,6- dimethyl- 4- oxo- 5,8- dihydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 3(6H)- yl)furan- 2- carboxamide
Smiles: CCCCc1nc2sc3c(c2c(=O)n1NC(=O)c1ccco1)CC(OC3)(C)C

STK526493
Synonyms: 2'- amino- 3'- chloro- 6'- (diethylamino)- 3H- spiro[2- benzofuran- 1,9'- xanthen]- 3- one
Smiles: CCN(c1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)cc(c(c1)Cl)N)CC

STK526495
Synonyms: 1- (2- fluorobenzyl)- 3,7- dimethyl- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1F

STK526496
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Clc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK526497
Synonyms: (2Z)- N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- hydroxy- 4- oxo- 4- phenylbut- 2- enamide
Smiles: O=C(/C(=C/C(=O)c1ccccc1)/O)Nc1c(=O)n(n(c1C)C)c1ccccc1

STK526498
Synonyms: ethyl6- amino- 5- cyano- 2- ({[3- cyano- 6- methyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydro- 1,6- naphthyridin- 2- yl]sulfanyl}methyl)- 4- phenyl- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc3CCN(Cc3c(c2C#N)c2cccs2)C)OC(=C(C1c1ccccc1)C#N)N

STK526499
Synonyms: [1- (naphthalen- 1- yl)ethenyl]phosphonicacid
Smiles: C=C(P(=O)(O)O)c1cccc2c1cccc2

STK526500
Synonyms: 2- (heptylsulfanyl)- 3- (4- methoxyphenyl)- 8,8- dimethyl- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC

STK526501
Synonyms: ethyl5- amino- 1,2,3- thiadiazole- 4- carboxylate
Smiles: CCOC(=O)c1nnsc1N

STK526502
Synonyms: ethyl2- ({(2E)- 3- [4- (benzyloxy)phenyl]- 2- cyanoprop- 2- enoyl}amino)- 4- phenylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)/C(=C/c1ccc(cc1)OCc1ccccc1)/C#N

STK526503
Synonyms: 5- ethyl- 2,2- dimethyl- N- pentyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- amine
Smiles: CCCCCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC

STK526505
Synonyms: (2R,3R,10bS)- 2- (4- methoxyphenyl)- 3- (phenylcarbonyl)- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2[C@H](C1(C#N)C#N)c1ccccc1C=C2

STK526506
Synonyms: 2- (dimethylamino)ethyl3- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoate
Smiles: CN(CCOC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)C

STK526507
Synonyms: N- {5- chloro- 2- [(1- chloronaphthalen- 2- yl)oxy]phenyl}- 2- hydroxy- 3,5- diiodobenzamide
Smiles: Clc1ccc(c(c1)NC(=O)c1cc(I)cc(c1O)I)Oc1ccc2c(c1Cl)cccc2

STK526508
Synonyms: 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bistetrazolo[1,5- a:1',5'- c]pyrimidine
Smiles: C1CCc2c(C1)sc1c2c2nnnn2c2n1nnn2

STK526509
Synonyms: 4- {[(2- butoxyphenyl)carbonyl]amino}butanoicacid
Smiles: CCCCOc1ccccc1C(=O)NCCCC(=O)O

STK526511
Synonyms: 3- (4- ethoxyphenyl)- 1,5- diphenyl- 4,5- dihydro- 1H- pyrazole
Smiles: CCOc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1

STK526512
Synonyms: [(3,4- dimethoxybenzyl)amino]acetonitrile
Smiles: N#CCNCc1ccc(c(c1)OC)OC

STK526515
Synonyms: 7- {2,3- bis[(2- chloro- 6- fluorobenzyl)oxy]propyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1cccc(c1COC(Cn1cnc2c1c(=O)n(C)c(=O)n2C)COCc1c(F)cccc1Cl)Cl

STK526517
Synonyms: 2- {[3- cyano- 6- (4- fluorophenyl)- 4- phenylpyridin- 2- yl]sulfanyl}- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nc(cc1c1ccccc1)c1ccc(cc1)F

STK526519
Synonyms: 8- ethyl- 6- [(2- hydroxyethyl)amino]- 3,3- dimethyl- 3,4- dihydro- 1H- thiopyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: OCCNc1nc(CC)c2c(c1C#N)CC(SC2)(C)C

STK526520
Synonyms: 5- {(6- hydroxy- 3- methyl- 4- oxo- 1- phenyl- 2- thioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)[4- methoxy- 3- (morpholin- 4- ium- 4- ylmethyl)phenyl]methyl}- 3- methyl- 6- oxo- 1- phenyl- 2- thioxo- 1,2,3,6- tetrahydropyrimidin- 4- o
Smiles: COc1ccc(cc1C[NH+]1CCOCC1)C(c1c([O-])n(C)c(=S)n(c1=O)c1ccccc1)c1c(O)n(c2ccccc2)c(=S)n(c1=O)C

STK526521
Synonyms: 8- ethyl- 3,3- dimethyl- 6- (morpholin- 4- yl)- 3,4- dihydro- 1H- thiopyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)SC2)CC)N1CCOCC1

STK526522
Synonyms: tert- butyl(8R,8aS)- 6- amino- 5,7,7- tricyano- 8- (4- methoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: N#CC1=C(N)C([C@H]([C@H]2C1=CCN(C2)C(=O)OC(C)(C)C)c1ccc(cc1)OC)(C#N)C#N

STK526523
Synonyms: (2R,3R,10bS)- 3- [(3,4- dimethoxyphenyl)carbonyl]- 2- (4- methoxyphenyl)- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(c(c2)OC)OC)N2[C@H](C1(C#N)C#N)c1ccccc1C=C2

STK526524
Synonyms: octyl5- (acetyloxy)- 6- bromo- 2- [(carbamimidoylsulfanyl)methyl]- 1- methyl- 1H- indole- 3- carboxylate
Smiles: CCCCCCCCOC(=O)c1c(CSC(=N)N)n(c2c1cc(OC(=O)C)c(c2)Br)C

STK526525
Synonyms: 1- [(4- ethoxybenzyl)oxy]guanidine
Smiles: CCOc1ccc(cc1)CONC(=N)N

STK526527
Synonyms: propan- 2- yl{5- [3- (piperidin- 1- yl)propanoyl]- 10,11- dihydro- 5H- dibenzo[b,f]azepin- 3- yl}carbamate
Smiles: CC(OC(=O)Nc1ccc2c(c1)N(C(=O)CCN1CCCCC1)c1ccccc1CC2)C

STK526528
Synonyms: butyl{[5- cyano- 3,3- dimethyl- 8- (morpholin- 4- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C

STK526531
Synonyms: diethyl(2- amino- 1- {[(3,4- dichlorophenyl)carbamoyl]amino}- 2- oxoethyl)phosphonate
Smiles: CCOP(=O)(C(C(=O)N)NC(=O)Nc1ccc(c(c1)Cl)Cl)OCC

STK526533
Synonyms: ethyl2- ({[2- (4- benzylpiperazin- 1- yl)- 5- nitrophenyl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(ccc2N2CCN(CC2)Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2

STK526534
Synonyms: N- benzyl- 5- ethyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- amine
Smiles: CCc1nc2sc3c(c2c2c1CCCC2)ncnc3NCc1ccccc1

STK526535
Synonyms: 1,3- bis(4- ethoxybenzyl)thiourea
Smiles: CCOc1ccc(cc1)CNC(=S)NCc1ccc(cc1)OCC

STK526537
Synonyms: 9- benzyl- 5- (ethylsulfanyl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCSc1nc2sc3c(c2c2n1cnn2)CCN(C3)Cc1ccccc1

STK526538
Synonyms: 4- bromo- 2- {(E)- [(4- phenyl- 1- {[(E)- phenylmethylidene]amino}- 1H- imidazol- 2- yl)imino]methyl}phenol
Smiles: Brc1ccc(c(c1)/C=N/c1nc(cn1/N=C/c1ccccc1)c1ccccc1)O

STK526540
Synonyms: 4- hydroxy- 5- propoxypentanehydrazide
Smiles: CCCOCC(CCC(=O)NN)O

STK526542
Synonyms: ethyl[5- (N- cyclohexylglycyl)- 10,11- dihydro- 5H- dibenzo[b,f]azepin- 3- yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)N(C(=O)CNC1CCCCC1)c1ccccc1CC2

STK526543
Synonyms: ethyl(2Z)- 5- [4- (acetyloxy)phenyl]- 2- (1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/1\c3ccccc3N(C1=O)CC)/s2

STK526544
Synonyms: 2- amino- 4- (4- fluorophenyl)- 7,7- dimethyl- 3- nitro- 4,6,7,8- tetrahydro- 5H- chromen- 5- one
Smiles: Fc1ccc(cc1)C1C2=C(OC(=C1[N+](=O)[O-])N)CC(CC2=O)(C)C

STK526545
Synonyms: 2- {[2- oxo- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]sulfanyl}- 6- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1ccc(nc1SCC(=O)C12CC3CC(C2)CC(C1)C3)C12CC3CC(C2)CC(C1)C3

STK526546
Synonyms: 1- [1- {5- [(2Z)- 2- (4- chlorobenzylidene)hydrazinyl]- 5- oxopentyl}- 3- (4- chlorophenyl)- 5,5- dimethyl- 2- oxoimidazolidin- 4- yl]- 3- (4- chlorophenyl)- 1- hydroxyurea
Smiles: O=C(N/N=C\c1ccc(cc1)Cl)CCCCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(cc1)Cl)O)c1ccc(cc1)Cl

STK526547
Synonyms: N- {(2Z)- 3- (4- nitrophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)/C(=C/c1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccccc1

STK526548
Synonyms: 2- [(3,4- dichlorophenyl)amino]- 2- oxoethyl[2- (2- methoxyphenoxy)ethyl]carbamodithioate
Smiles: COc1ccccc1OCCNC(=S)SCC(=O)Nc1ccc(c(c1)Cl)Cl

STK526550
Synonyms: 4- (4- methylphenyl)- 1- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

STK526551
Synonyms: 3- (4- methoxyphenyl)- 8,8- dimethyl- 2- (methylsulfanyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC

STK526554
Synonyms: ethyl3- [(2Z)- azepan- 2- ylideneamino]- 4- carbamoyl- 5- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1/N=C\1/CCCCCN1)C(=O)N)C

STK526555
Synonyms: 7- (4- acetylpiperazin- 1- yl)- 1- cyclopropyl- 6- nitro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CC(=O)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1[N+](=O)[O-])C(=O)O)C1CC1

STK526556
Synonyms: 4- (4- benzylpiperazin- 1- yl)- N- (4- chlorophenyl)- 3- nitrobenzamide
Smiles: Clc1ccc(cc1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1

STK526557
Synonyms: 6- [butyl(ethyl)amino]- 3,3- dimethyl- 8- phenyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCCCN(c1nc(c2ccccc2)c2c(c1C#N)CC(OC2)(C)C)CC

STK526561
Synonyms: 7- benzyl- 1- (3,3- dimethylpiperidin- 1- yl)- 3- (morpholin- 4- yl)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: N#Cc1c2CCN(Cc2c(nc1N1CCOCC1)N1CCCC(C1)(C)C)Cc1ccccc1

STK526564
Synonyms: ({3- [(4- methylphenyl)carbonyl]- 1- benzofuran- 5- yl}oxy)aceticacid
Smiles: OC(=O)COc1ccc2c(c1)c(co2)C(=O)c1ccc(cc1)C

STK526565
Synonyms: 6- amino- 4- (4- bromo- 2- fluorophenyl)- 3- methyl- 1- phenyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1F)Br)c(C)nn2c1ccccc1

STK526566
Synonyms: 3- (morpholin- 4- yl)- 1- [4- (pentyloxy)phenyl]- 2- phenylpropan- 1- ol
Smiles: CCCCCOc1ccc(cc1)C(C(c1ccccc1)CN1CCOCC1)O

STK526567
Synonyms: 6- [(4- bromobenzyl)sulfanyl]- 3,3- dimethyl- 8- (morpholin- 4- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)Br)nc(c2c1CC(C)(C)OC2)N1CCOCC1

STK526568
Synonyms: 5- butyl- 8- (propylsulfanyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCCC

STK526570
Synonyms: 3,3- dimethyl- 8- (4- methylpiperazin- 1- yl)- 6- (methylsulfanyl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CSc1nc(N2CCN(CC2)C)c2c(c1C#N)CC(OC2)(C)C

STK526571
Synonyms: 2,2- dimethyl- 5- (morpholin- 4- yl)- N- (prop- 2- en- 1- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 8- amine
Smiles: C=CCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK526572
Synonyms: 5,5'- {[4- (benzyloxy)phenyl]methanediyl}dipyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(C(=O)N1)C(C1C(=O)NC(=O)NC1=O)c1ccc(cc1)OCc1ccccc1

STK526573
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 3- (piperidin- 1- yl)propan- 1- one
Smiles: O=C(c1ccc2c(c1)OCCO2)CCN1CCCCC1

STK526575
Synonyms: N,N'- hexane- 1,6- diylbis(4- propoxybenzenesulfonamide)
Smiles: CCCOc1ccc(cc1)S(=O)(=O)NCCCCCCNS(=O)(=O)c1ccc(cc1)OCCC

STK526576
Synonyms: N,N'- (sulfanediyldibenzene- 4,1- diyl)bis(4- chlorobenzamide)
Smiles: O=C(c1ccc(cc1)Cl)Nc1ccc(cc1)Sc1ccc(cc1)NC(=O)c1ccc(cc1)Cl

STK526577
Synonyms: 4,4'- selanylbis[3- (2- methylpropyl)- 1H- pyrazole]
Smiles: CC(Cc1n[nH]cc1[Se]c1c[nH]nc1CC(C)C)C

STK526578
Synonyms: 3,4,7,8,9,10- hexahydro- 2H,6H- [1]benzothieno[2',3':4,5]pyrimido[2,1- b][1,3]thiazin- 6- one
Smiles: O=c1c2c(sc3c2CCCC3)nc2n1CCCS2

STK526579
Synonyms: 6,6- dimethyl- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3- phenyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK526582
Synonyms: 6- [(3- hydroxypropyl)amino]- 3,3,8- trimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: OCCCNc1nc(C)c2c(c1C#N)CC(OC2)(C)C

STK526583
Synonyms: 2,2,2- trifluoro- 1- (pentafluorophenyl)- 1- (quinolin- 6- yl)ethanol
Smiles: Fc1c(F)c(F)c(c(c1C(C(F)(F)F)(c1ccc2c(c1)cccn2)O)F)F

STK526584
Synonyms: N- (2- {(2E)- 2- [1- (furan- 2- yl)ethylidene]hydrazinyl}- 2- oxoethyl)- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide(non- preferredname)
Smiles: O=C(N/N=C(/c1ccco1)\C)CNC(=O)C1COc2c(O1)cccc2

STK526586
Synonyms: 3- phenyl- 2- thioxo- 2,3,6,7,8,9- hexahydropyrimido[4,5- b]quinolin- 4(1H)- one
Smiles: S=c1[nH]c2nc3CCCCc3cc2c(=O)n1c1ccccc1

STK526587
Synonyms: 3- (3- chlorophenyl)- 1- [3- (3- chlorophenyl)- 1- (2- methoxybenzyl)- 5,5- dimethyl- 2- oxoimidazolidin- 4- yl]- 1- hydroxyurea
Smiles: COc1ccccc1CN1C(=O)N(C(C1(C)C)N(C(=O)Nc1cccc(c1)Cl)O)c1cccc(c1)Cl

STK526590
Synonyms: methyl(2Z)- 2- [(1,3- diphenyl- 1H- pyrazol- 4- yl)methylidene]- 7- methyl- 3- oxo- 5- phenyl- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cn(nc1c1ccccc1)c1ccccc1)/s2

STK526593
Synonyms: ethyl6- amino- 2- ({[4- (4- chlorophenyl)- 3- cyano- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}methyl)- 5- cyano- 4- (thiophen- 2- yl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc(cc(c2C#N)c2ccc(cc2)Cl)c2cccs2)OC(=C(C1c1cccs1)C#N)N

STK526594
Synonyms: 6- amino- 4- (naphthalen- 1- yl)- 1- phenyl- 3- (trifluoromethyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc3c1cccc3)c(nn2c1ccccc1)C(F)(F)F

STK526596
Synonyms: 4- (4- chlorophenyl)- 7,7- dimethyl- 5- oxo- 2- {[2- oxo- 2- (2- oxo- 2H- chromen- 3- yl)ethyl]sulfanyl}- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc2c(c1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

STK526597
Synonyms: 4- (3- methylphenyl)- 1- (propan- 2- ylsulfanyl)- 4H- spiro[benzo[h][1,2,4]triazolo[4,3- a]quinazoline- 6,1'- cyclohexan]- 5(7H)- one
Smiles: CC(Sc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1cccc(c1)C)CCCCC3)C

STK526598
Synonyms: 5- bromo- N- [3- cyano- 1- (4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]furan- 2- carboxamide
Smiles: COc1ccc(cc1)n1c2nc3ccccc3nc2c(c1NC(=O)c1ccc(o1)Br)C#N

STK526601
Synonyms: 1- benzyl- 2- methyl- 8- phenyl- 1,5,6,7- tetrahydrocyclopenta[b]pyrrolo[2,3- e]pyridine- 3- carbonitrile
Smiles: N#Cc1c2nc3CCCc3c(c2n(c1C)Cc1ccccc1)c1ccccc1

STK526602
Synonyms: 1- [(3- methylbutyl)sulfanyl]- 4- phenyl- 7,8,9,10- tetrahydro- 6H- cyclohepta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCCC3)C

STK526603
Synonyms: 1- [3- amino- 6- tert- butyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl]- 2,2- dimethylpropan- 1- one
Smiles: Nc1c2c(sc1C(=O)C(C)(C)C)nc1c(c2c2cccs2)CC(CC1)C(C)(C)C

STK526604
Synonyms: ethyl[5- (N- tert- butylglycyl)- 10,11- dihydro- 5H- dibenzo[b,f]azepin- 3- yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)N(C(=O)CNC(C)(C)C)c1ccccc1CC2

STK526605
Synonyms: dimethylhydroxy[(phenylcarbonyl)amino]propanedioate
Smiles: COC(=O)C(C(=O)OC)(NC(=O)c1ccccc1)O

STK526606
Synonyms: N- hexyl- 2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 8- amine
Smiles: CCCCCCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK526608
Synonyms: ethyl{[4- (4- methoxyphenyl)- 5- oxo- 4,5,7,8,9,10- hexahydro- 6H- cyclohepta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CCCCC3

STK526614
Synonyms: 2,3- dimethoxy- 6- [(E)- {2- [({N- [(4- nitrophenyl)carbonyl]glycyl}amino)acetyl]hydrazinylidene}methyl]benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)/C=N/NC(=O)CNC(=O)CNC(=O)c1ccc(cc1)[N+](=O)[O-]

STK526615
Synonyms: 3- benzyl- 2- (prop- 2- yn- 1- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK526616
Synonyms: 5- octadecyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCCCCCCCCCCCCCCCC1C(=O)NC(=S)NC1=O

STK526617
Synonyms: 8- tert- butyl- 1- methyl- 4- phenyl- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: O=c1c2c3CCC(Cc3sc2n2c(n1c1ccccc1)nnc2C)C(C)(C)C

STK526618
Synonyms: (2E)- 1- (4- bromophenyl)- 3- (9- methyl- 9H- carbazol- 3- yl)prop- 2- en- 1- one
Smiles: Brc1ccc(cc1)C(=O)/C=C/c1ccc2c(c1)c1ccccc1n2C

STK526619
Synonyms: 4- hydroxy- 2,2,6,6- tetramethylpiperidine- 4- carbonitrile
Smiles: N#CC1(O)CC(C)(C)NC(C1)(C)C

STK526621
Synonyms: (8S,8aS)- 6- amino- 2- benzyl- 8- (2- chloro- 6- fluorophenyl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@H]([C@H]2C1=CCN(C2)Cc1ccccc1)c1c(F)cccc1Cl)(C#N)C#N

STK526622
Synonyms: 6- {[2- (dimethylamino)ethyl]amino}- 8- ethyl- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(NCCN(C)C)nc(c2c1CC(C)(C)OC2)CC

STK526623
Synonyms: ethyl{[3- (4- methoxyphenyl)- 8,8- dimethyl- 4- oxo- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC

STK526624
Synonyms: 4- propoxybenzylcarbamimidothioate
Smiles: CCCOc1ccc(cc1)CSC(=N)N

STK526626
Synonyms: 8- butoxy- 2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCOc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK526627
Synonyms: ethyl4- (4- bromophenyl)- 2- {[(2E)- 2- cyano- 3- (5- methylfuran- 2- yl)prop- 2- enoyl]amino}thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)/C(=C/c1ccc(o1)C)/C#N

STK526628
Synonyms: (2E)- 2- [5- bromo- 1- (2- chloroethyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinecarbothioamide
Smiles: ClCCN1C(=O)/C(=N/NC(=S)N)/c2c1ccc(c2)Br

STK526629
Synonyms: 4- benzyl- 1- (propylsulfanyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCC3

STK526633
Synonyms: 4- oxo- 4- (thiophen- 2- yl)butanoicacid
Smiles: OC(=O)CCC(=O)c1cccs1

STK526636
Synonyms: N- ethyl- N- [(3- methylnaphthalen- 2- yl)methyl]ethanamine
Smiles: CCN(Cc1cc2ccccc2cc1C)CC

STK526638
Synonyms: 4- butyl- 1- [(2- oxo- 2- phenylethyl)sulfanyl]- 7,8,9,10- tetrahydro- 6H- cyclohepta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCCn1c2nnc(n2c2c(c1=O)c1CCCCCc1s2)SCC(=O)c1ccccc1

STK526641
Synonyms: (6aS,8S,9R)- 8- (2,4- diethoxyphenyl)- 9- (phenylcarbonyl)- 8,9- dihydropyrrolo[1,2- a][1,5]naphthyridine- 7,7(6aH)- dicarbonitrile
Smiles: CCOc1cc(OCC)ccc1[C@H]1[C@H](C(=O)c2ccccc2)N2[C@H](C1(C#N)C#N)C=Cc1c2cccn1

STK526642
Synonyms: 4,4',4'',4'''- porphyrin- 5,10,15,20- tetrayltetraaniline
Smiles: Nc1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1ccc(cc1)N)/C=C3)\c1ccc(cc1)N)/[nH]2)/c1ccc(cc1)N

STK526643
Synonyms: 4- [5- cyano- 8- (furan- 2- yl)- 3,3- dimethyl- 3,4- dihydro- 1H- thiopyrano[3,4- c]pyridin- 6- yl]- N- phenylpiperazine- 1- carbothioamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)SC2)c1ccco1)N1CCN(CC1)C(=S)Nc1ccccc1

STK526644
Synonyms: 4,4'- [(6- methoxy- 1,3,5- triazine- 2,4- diyl)bis(oxy)]bis(N- phenylbenzamide)
Smiles: COc1nc(Oc2ccc(cc2)C(=O)Nc2ccccc2)nc(n1)Oc1ccc(cc1)C(=O)Nc1ccccc1

STK526645
Synonyms: 5- benzyl- 2,6- diiodopyridin- 3- ol
Smiles: Ic1nc(I)c(cc1Cc1ccccc1)O

STK526647
Synonyms: 1,3- bis(3,4- dichlorobenzyl)- 5- fluoropyrimidine- 2,4(1H,3H)- dione
Smiles: Clc1ccc(cc1Cl)Cn1cc(F)c(=O)n(c1=O)Cc1ccc(c(c1)Cl)Cl

STK526651
Synonyms: 2,5- di- tert- butyl- 3- hydroxy- 6- methoxycyclohexa- 2,5- diene- 1,4- dione
Smiles: COC1=C(C(=O)C(=C(C1=O)C(C)(C)C)O)C(C)(C)C

STK526656
Synonyms: ethyl(2Z)- 2- [2- (4- nitrophenyl)hydrazinylidene]- 3- phenylpropanoate
Smiles: CCOC(=O)/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/Cc1ccccc1

STK526658
Synonyms: 2- phenoxyethyl2- aminobenzoate
Smiles: O=C(c1ccccc1N)OCCOc1ccccc1

STK526659
Synonyms: 7- benzyl- 3- (morpholin- 4- yl)- 1- (prop- 2- en- 1- ylamino)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: C=CCNc1nc(N2CCOCC2)c(c2c1CN(CC2)Cc1ccccc1)C#N

STK526660
Synonyms: 3- (3- chlorophenyl)- 1- {3- (3- chlorophenyl)- 1- [2- (2- methoxyphenyl)ethyl]- 5,5- dimethyl- 2- oxoimidazolidin- 4- yl}- 1- hydroxyurea
Smiles: COc1ccccc1CCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1cccc(c1)Cl)O)c1cccc(c1)Cl

STK526661
Synonyms: 3- [4- (propan- 2- yloxy)phenyl]- N'- [(E)- pyridin- 4- ylmethylidene]propanehydrazide
Smiles: O=C(CCc1ccc(cc1)OC(C)C)N/N=C/c1ccncc1

STK526663
Synonyms: 3- cyano- 6- oxo- 5- [4- (pyridin- 4- yl)pyridinium- 1- yl]- 4- [2- (trifluoromethyl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- olate
Smiles: N#CC1=C([O-])NC(=O)C(C1c1ccccc1C(F)(F)F)[n+]1ccc(cc1)c1ccncc1

STK526665
Synonyms: 1- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl]phthalazine
Smiles: COc1ccc(cc1)/C=N/Nc1nncc2c1cccc2

STK526667
Synonyms: 7- ethyl- 1- [(2- hydroxyethyl)amino]- 3- (piperidin- 1- yl)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: OCCNc1nc(N2CCCCC2)c(c2c1CN(CC)CC2)C#N

STK526669
Synonyms: 2- amino- 4- (5- bromothiophen- 2- yl)- 5- oxo- 4H,5H- pyrano[3,2- c]chromene- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(s1)Br)c(=O)oc1c2cccc1

STK526671
Synonyms: (2Z)- 5- amino- 3- oxo- 2- [2- (trifluoromethyl)benzylidene]- 7- [3- (trifluoromethyl)phenyl]- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyridine- 6,8- dicarbonitrile
Smiles: N#CC1=c2s/c(=C\c3ccccc3C(F)(F)F)/c(=O)n2C(=C(C1c1cccc(c1)C(F)(F)F)C#N)N

STK526672
Synonyms: N'- (3,6,6- trimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)propanehydrazide
Smiles: CCC(=O)NNc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK526673
Synonyms: 6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK526674
Synonyms: 2- [(5E)- 5- {[5- (4- bromophenyl)furan- 2- yl]methylidene}- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 3- methylbutanoicacid
Smiles: CC(C(N1C(=S)S/C(=C/c2ccc(o2)c2ccc(cc2)Br)/C1=O)C(=O)O)C

STK526675
Synonyms: 2,6- bis[4- (dimethylamino)phenyl]- 3,5- dimethylpiperidin- 4- one
Smiles: CC1C(=O)C(C)C(NC1c1ccc(cc1)N(C)C)c1ccc(cc1)N(C)C

STK526676
Synonyms: 2- (1H- benzimidazol- 2- yl)- 3- [2- (difluoromethoxy)phenyl]propanenitrile
Smiles: N#CC(c1nc2c([nH]1)cccc2)Cc1ccccc1OC(F)F

STK526677
Synonyms: ethyl2,4,5,6- tetrachloropyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(Cl)nc(c(c1Cl)Cl)Cl

STK526678
Synonyms: [(2- methylquinolin- 4- yl)oxy]aceticacid
Smiles: OC(=O)COc1cc(C)nc2c1cccc2

STK526679
Synonyms: 1- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 4- phenyl- 7,8,9,10- tetrahydro- 6H- cyclohepta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCCC3

STK526680
Synonyms: 2,4- dibromo- 6- {(E)- [(4,5- diphenyl- 1- {[(E)- phenylmethylidene]amino}- 1H- imidazol- 2- yl)imino]methyl}phenol
Smiles: Brc1cc(/C=N/c2nc(c(n2/N=C/c2ccccc2)c2ccccc2)c2ccccc2)c(c(c1)Br)O

STK526681
Synonyms: N- [2- (triphenyl- lambda~5~- phosphanylidene)acetyl]benzamide
Smiles: O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)c1ccccc1

STK526683
Synonyms: 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (4- methylphenyl)- 4H- spiro[benzo[h][1,2,4]triazolo[4,3- a]quinazoline- 6,1'- cyclohexan]- 5(7H)- one
Smiles: Cc1ccc(cc1)n1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCC(=O)c1ccc(cc1)Cl

STK526684
Synonyms: (2Z)- 2,3,4,5,5- pentachloropenta- 2,4- dienoicacid
Smiles: ClC(=C(/C(=C(\C(=O)O)/Cl)/Cl)Cl)Cl

STK526685
Synonyms: N- (2- {(2E)- 2- [2- (benzyloxy)- 5- bromobenzylidene]hydrazinyl}- 2- oxoethyl)- 2,3- dihydro- 1,4- benzodioxine- 6- carboxamide(non- preferredname)
Smiles: O=C(CNC(=O)c1ccc2c(c1)OCCO2)N/N=C/c1cc(Br)ccc1OCc1ccccc1

STK526686
Synonyms: N- {(2E)- 3- (3- nitrophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}valine
Smiles: CC(C(C(=O)O)NC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1)C

STK526687
Synonyms: 3- (4- chlorophenyl)- 1- [3- (4- chlorophenyl)- 5,5- dimethyl- 1- {5- [(2Z)- 2- (3- nitrobenzylidene)hydrazinyl]- 5- oxopentyl}- 2- oxoimidazolidin- 4- yl]- 1- hydroxyurea
Smiles: O=C(N/N=C\c1cccc(c1)[N+](=O)[O-])CCCCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(cc1)Cl)O)c1ccc(cc1)Cl

STK526688
Synonyms: 1- (4- iodophenyl)- 9- phenyl- 5,6,7,8- tetrahydro- 1H- imidazo[4,5- b]quinoline
Smiles: Ic1ccc(cc1)n1cnc2c1c(c1ccccc1)c1c(n2)CCCC1

STK526689
Synonyms: 4- benzyl- 1- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 4H- spiro[benzo[h][1,2,4]triazolo[4,3- a]quinazoline- 6,1'- cyclohexan]- 5(7H)- one
Smiles: CC(=C)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccccc1)CCCCC3

STK526690
Synonyms: N'- [2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 8- yl]- N,N- diethylethane- 1,2- diamine
Smiles: CCN(CCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)CC

STK526691
Synonyms: (1S,2S,3aR)- 2- (4- methoxyphenyl)- 1- (phenylcarbonyl)- 1,2- dihydrobenzo[h]pyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2ccc(cc2)OC)[C@H](N2[C@@H]1C=Cc1c2c2ccccc2cc1)C(=O)c1ccccc1

STK526692
Synonyms: 1,7- dibenzyl- 8- [(2- hydroxyethyl)amino]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK526693
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (4- fluorophenyl)- 6- phenylpyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)Cl)nc(cc1c1ccc(cc1)F)c1ccccc1

STK526694
Synonyms: diethyl[(1E)- 2- amino- N- {[(2- chloro- 4- nitrophenyl)carbonyl]oxy}- 2- oxoethanimidoyl]phosphonate
Smiles: CCOP(=O)(/C(=N/OC(=O)c1ccc(cc1Cl)[N+](=O)[O-])/C(=O)N)OCC

STK526695
Synonyms: trifluoromethyl(8S,8aR)- 6- amino- 8- (3- chlorophenyl)- 5,7,7- tricyano- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OC(F)(F)F)c1cccc(c1)Cl)(C#N)C#N

STK526697
Synonyms: 3,3'- piperazine- 1,4- diylbis(5,5- dimethyl- 2- nitrocyclohex- 2- en- 1- one)
Smiles: [O-][N+](=O)C1=C(CC(CC1=O)(C)C)N1CCN(CC1)C1=C([N+](=O)[O-])C(=O)CC(C1)(C)C

STK526698
Synonyms: 2- [2- (9H- carbazol- 9- yl)ethoxy]ethanol
Smiles: OCCOCCn1c2ccccc2c2c1cccc2

STK526700
Synonyms: (3- amino- 6- butylthieno[2,3- b]pyridin- 2- yl)(4- bromophenyl)methanone
Smiles: CCCCc1ccc2c(n1)sc(c2N)C(=O)c1ccc(cc1)Br

STK526702
Synonyms: N- (4- methoxybenzyl)- 1,2,5- trimethylpiperidin- 4- amine
Smiles: COc1ccc(cc1)CNC1CC(C)N(CC1C)C

STK526704
Synonyms: 4- methyl- 7- (naphthalen- 1- ylmethoxy)- 2H- chromen- 2- one
Smiles: O=c1cc(C)c2c(o1)cc(cc2)OCc1cccc2c1cccc2

STK526705
Synonyms: 3- (2- thioxo- 1,3- benzoxazol- 3(2H)- yl)propanoicacid
Smiles: OC(=O)CCn1c(=S)oc2c1cccc2

STK526706
Synonyms: (5Z)- 5- {3- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methoxybenzylidene}- 1- (2- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1F

STK526707
Synonyms: 6- {[2- (dimethylamino)ethyl]amino}- 3,3- dimethyl- 8- phenyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(NCCN(C)C)nc(c2c1CC(C)(C)OC2)c1ccccc1

STK526709
Synonyms: (2E)- 2- (4- propoxybenzylidene)hydrazinecarbothioamide
Smiles: CCCOc1ccc(cc1)/C=N/NC(=S)N

STK526710
Synonyms: diethyl[(1E)- 2- amino- N- {[(2- bromophenyl)carbonyl]oxy}- 2- oxoethanimidoyl]phosphonate
Smiles: CCOP(=O)(/C(=N/OC(=O)c1ccccc1Br)/C(=O)N)OCC

STK526712
Synonyms: tert- butyl(8R)- 6- amino- 8- (4- bromophenyl)- 5,7,7- tricyano- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: N#CC1=C(N)C([C@H](C2C1=CCN(C2)C(=O)OC(C)(C)C)c1ccc(cc1)Br)(C#N)C#N

STK526716
Synonyms: 2- (benzylsulfanyl)- 6,6- dimethyl- 3- (2- methylpropyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(Cn1c(SCc2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2)C

STK526717
Synonyms: ethoxy(diphenyl)aceticacid
Smiles: CCOC(c1ccccc1)(c1ccccc1)C(=O)O

STK526720
Synonyms: 1- [4- (2- methylpropoxy)phenyl]- 2- phenyl- 3- (piperidin- 1- yl)propan- 1- ol
Smiles: CC(COc1ccc(cc1)C(C(c1ccccc1)CN1CCCCC1)O)C

STK526721
Synonyms: 2,2- dimethyl- 5- propyl- 2,3- dihydro- 1H- pyrano[3'',2'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8(9H)- one
Smiles: CCCc1nc2sc3c(c2c2c1OCC(C2)(C)C)nc[nH]c3=O

STK526723
Synonyms: 6- (ethylsulfanyl)- 2,3'- bipyridine- 5- carbonitrile
Smiles: CCSc1nc(ccc1C#N)c1cccnc1

STK526724
Synonyms: 2- ({5- [(2,4- dichlorophenoxy)methyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- 1- [4- (methylsulfanyl)phenyl]ethanone
Smiles: CSc1ccc(cc1)C(=O)CSc1nnc(o1)COc1ccc(cc1Cl)Cl

STK526725
Synonyms: ethyl2- amino- 4- [4- (benzyloxy)phenyl]- 7- methyl- 5- oxo- 4H,5H- pyrano[4,3- b]pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccccc1)c(=O)oc(c2)C

STK526726
Synonyms: ethyl(8R,8aR)- 6- amino- 5,7,7- tricyano- 8- (2,3- dimethoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1cccc(c1OC)OC)C(C(=C2C#N)N)(C#N)C#N

STK526727
Synonyms: 3,3- dimethyl- 6- {[2- (morpholin- 4- yl)ethyl]amino}- 8- phenyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(NCCN2CCOCC2)nc(c2c1CC(C)(C)OC2)c1ccccc1

STK526728
Synonyms: ethyl2- {[(3- {[(4- methylphenyl)sulfonyl]amino}naphthalen- 2- yl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc3ccccc3cc2NS(=O)(=O)c2ccc(cc2)C)sc2c1CCCC2

STK526729
Synonyms: 2- (4,5- dihydro- 1,3- thiazol- 2- ylamino)- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CNC1=NCCS1)c(n2C)C

STK526730
Synonyms: 6- amino- 4- (3- iodophenyl)- 3- methyl- 1- phenyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)I)c(C)nn2c1ccccc1

STK526731
Synonyms: N- {(2E,4E)- 1- [2- (4- nitrophenyl)hydrazinyl]- 1- oxo- 5- phenylpenta- 2,4- dien- 2- yl}benzamide
Smiles: O=C(/C(=C\C=C\c1ccccc1)/NC(=O)c1ccccc1)NNc1ccc(cc1)[N+](=O)[O-]

STK526732
Synonyms: 4- (4- methoxyphenyl)- 1- (methylsulfanyl)- 7,8,9,10- tetrahydro- 6H- cyclohepta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: COc1ccc(cc1)n1c(=O)c2c3CCCCCc3sc2n2c1nnc2SC

STK526735
Synonyms: 1- {3- [(diethylamino)methyl]- 4- ethoxyphenyl}ethanone
Smiles: CCOc1ccc(cc1CN(CC)CC)C(=O)C

STK526736
Synonyms: 6- [2- (4- bromophenyl)- 2- oxoethoxy]- 8- butyl- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCCCc1nc(OCC(=O)c2ccc(cc2)Br)c(c2c1COC(C2)(C)C)C#N

STK526737
Synonyms: 1,8,8- trimethyl- 3- (4- methylphenyl)- 3- azabicyclo[3.2.1]octane- 2,4- dione
Smiles: Cc1ccc(cc1)N1C(=O)C2CCC(C1=O)(C2(C)C)C

STK526738
Synonyms: ethyl(2Z)- 2- [(1,3- diphenyl- 1H- pyrazol- 4- yl)methylidene]- 7- methyl- 5- (4- methylphenyl)- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1cn(nc1c1ccccc1)c1ccccc1)/s2

STK526739
Synonyms: 1- {3- [(2- amino- 4,6- dihydroxypyrimidin- 5- yl)methyl]- 4- ethoxyphenyl}ethanone
Smiles: CCOc1ccc(cc1Cc1c(O)nc(nc1O)N)C(=O)C

STK526740
Synonyms: N- cyclohexyl- 5- methyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- amine
Smiles: Cc1nc2sc3c(c2c2c1CCCC2)ncnc3NC1CCCCC1

STK526741
Synonyms: 5- {(6- hydroxy- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)[4- methoxy- 3- (pyrrolidinium- 1- ylmethyl)phenyl]methyl}- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)[nH]c(=O)[nH]c1=O)c1c([O-])[nH]c(=O)[nH]c1=O

STK526742
Synonyms: benzyl3- amino- 6- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)thieno[2,3- b]pyridine- 2- carboxylate
Smiles: O=C(c1sc2c(c1N)ccc(n2)C12CC3CC(C2)CC(C1)C3)OCc1ccccc1

STK526744
Synonyms: (2Z)- 1- (4- nitrophenyl)- 2- (1,3,3- trimethyl- 1,3- dihydro- 2H- indol- 2- ylidene)ethanone
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/1\N(C)c2c(C1(C)C)cccc2

STK526745
Synonyms: ethenyl{[3- cyano- 4- (4- fluorophenyl)- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetate
Smiles: C=COC(=O)CSc1nc(cc(c1C#N)c1ccc(cc1)F)c1cccs1

STK526746
Synonyms: {4- [(4- chlorophenyl)amino]- 6- (diethylamino)- 1,3,5- triazin- 2- yl}cyanamide
Smiles: N#CNc1nc(Nc2ccc(cc2)Cl)nc(n1)N(CC)CC

STK526747
Synonyms: 1- (3,5- dibromo- 2- hydroxyphenyl)propan- 1- one
Smiles: CCC(=O)c1cc(Br)cc(c1O)Br

STK526749
Synonyms: 1- (cyclohexylamino)- 7- methyl- 3- (morpholin- 4- yl)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: N#Cc1c(nc(c2c1CCN(C2)C)NC1CCCCC1)N1CCOCC1

STK526750
Synonyms: (3Z,5Z)- 3- [(benzylamino)methylidene]- 5- benzylidenepyrrolidine- 2,4- dione
Smiles: O=C1N/C(=C\c2ccccc2)/C(=O)/C/1=C/NCc1ccccc1

STK526751
Synonyms: ethyl6- [(2- tert- butoxy- 2- oxoethyl)sulfanyl]- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)OC(C)(C)C

STK526755
Synonyms: 1- (pentylsulfanyl)- 4- (2- phenylethyl)- 4H- spiro[benzo[h][1,2,4]triazolo[4,3- a]quinazoline- 6,1'- cyclohexan]- 5(7H)- one
Smiles: CCCCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2CCc1ccccc1)CCCCC3

STK526758
Synonyms: methyl(2Z)- 2- {[3- (4- chlorophenyl)- 1- phenyl- 1H- pyrazol- 4- yl]methylidene}- 5- (4- methoxyphenyl)- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)Cl)c1ccccc1)/s2

STK526759
Synonyms: N'- [2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 8- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)C

STK526760
Synonyms: 1,3- dichloro- 7- ethyl- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: CCN1CCc2c(C1)c(Cl)nc(c2C#N)Cl

STK526761
Synonyms: ethyl2- {[5- cyano- 3,3- dimethyl- 8- (morpholin- 4- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C)C

STK526762
Synonyms: dipropan- 2- yl[(1Z)- 2- amino- N- {[(3- iodophenyl)carbonyl]oxy}- 2- oxoethanimidoyl]phosphonate
Smiles: CC(OP(=O)(/C(=N\OC(=O)c1cccc(c1)I)/C(=O)N)OC(C)C)C

STK526764
Synonyms: 5- chloro- N- {3- chloro- 4- [(1- chloronaphthalen- 2- yl)oxy]phenyl}- 2- {[(4- chlorophenyl)sulfonyl]amino}benzamide
Smiles: Clc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)Oc1ccc2c(c1Cl)cccc2)NS(=O)(=O)c1ccc(cc1)Cl

STK526765
Synonyms: dimethylN',N'''- [(2- hydroxy- 5- methylbenzene- 1,3- diyl)di(E)methylylidene]biscarbamohydrazonothioate
Smiles: CS/C(=N/N=C/c1cc(C)cc(c1O)/C=N/N=C(/SC)\N)/N

STK526766
Synonyms: 4- (4- methylphenyl)- 1- (propylsulfanyl)- 4H- spiro[benzo[h][1,2,4]triazolo[4,3- a]quinazoline- 6,1'- cyclohexan]- 5(7H)- one
Smiles: CCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCCC3

STK526767
Synonyms: 4- (4- methoxyphenyl)- 1- (prop- 2- en- 1- ylsulfanyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CCC3

STK526768
Synonyms: (2R,3R,10bS)- 3- [(4- methoxyphenyl)carbonyl]- 2- (thiophen- 2- yl)- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2cccs2)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)c1ccc(cc1)OC

STK526770
Synonyms: ethyl{[6,6- dimethyl- 3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 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)n1CC(=C)C)CC(OC3)(C)C

STK526771
Synonyms: propyl{[5- cyano- 3,3- dimethyl- 8- (morpholin- 4- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C

STK526772
Synonyms: 2- amino- 4- {4- methoxy- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]phenyl}- 4a,5,6,7- tetrahydronaphthalene- 1,3,3(4H)- tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(c(c1)Cn1ncc(c1)[N+](=O)[O-])OC)(C#N)C#N

STK526773
Synonyms: 2- (heptylsulfanyl)- 6,6- dimethyl- 3- (2- phenylethyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK526776
Synonyms: 5- butyl- 8- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3N1CCOCC1

STK526777
Synonyms: 6- amino- 8- (3- bromo- 4- fluorophenyl)- 2- methyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C)c1ccc(c(c1)Br)F)(C#N)C#N

STK526778
Synonyms: (4R,7S)- 2- hydroxy- 3a,4,7,7a- tetrahydro- 1H- 4,7- epoxyisoindole- 1,3(2H)- dione
Smiles: ON1C(=O)C2C(C1=O)[C@@H]1O[C@H]2C=C1

STK526779
Synonyms: N- (4- fluorobenzyl)- 4- (9H- xanthen- 9- yl)aniline
Smiles: Fc1ccc(cc1)CNc1ccc(cc1)C1c2ccccc2Oc2c1cccc2

STK526780
Synonyms: 4- benzyl- 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCC3

STK526781
Synonyms: 8- (biphenyl- 4- yloxy)- 7- (4- bromobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1ccc(cc1)Cn1c(Oc2ccc(cc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK526782
Synonyms: ethyl6- amino- 5- cyano- 4- (2- iodophenyl)- 2- phenyl- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccccc1I)C#N)N)c1ccccc1

STK526783
Synonyms: 7- benzyl- 3- chloro- 1- (cyclohexylamino)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: N#Cc1c(Cl)nc(c2c1CCN(C2)Cc1ccccc1)NC1CCCCC1

STK526784
Synonyms: 1- (azepan- 1- yl)- 3- (8- cyclohexyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)propan- 2- ol
Smiles: OC(CN1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1)CN1CCCCCC1

STK526786
Synonyms: 2- [(3,5- di- tert- butyl- 4- hydroxyphenyl)sulfanyl]- N- [2- (1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(CSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)NCCc1c[nH]c2c1cccc2

STK526789
Synonyms: 4- (4- methylphenyl)- 1- (propan- 2- ylsulfanyl)- 4H- spiro[benzo[h][1,2,4]triazolo[4,3- a]quinazoline- 6,1'- cyclohexan]- 5(7H)- one
Smiles: CC(Sc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCCC3)C

STK526790
Synonyms: 2- [(4- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 3- phenyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Fc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK526791
Synonyms: [3- amino- 4- (4- methoxyphenyl)- 6- phenylthieno[2,3- b]pyridin- 2- yl](biphenyl- 4- yl)methanone
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)c1ccc(cc1)c1ccccc1)c1ccccc1

STK526794
Synonyms: N'- [(2- bromo- 1- methylcyclopropyl)carbonyl]- 3- nitrobenzohydrazide
Smiles: BrC1CC1(C)C(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]

STK526796
Synonyms: 3- (3,5- di- tert- butyl- 4- hydroxybenzyl)pentane- 2,4- dione
Smiles: CC(=O)C(C(=O)C)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK526798
Synonyms: ethyl6- ethyl- 2- [(phenylcarbamothioyl)amino]- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CCN(C2)CC

STK526799
Synonyms: 2- [2- benzyl- 4- hydroxy- 5- (3- methylbutoxy)pentanoyl]- N- phenylhydrazinecarbothioamide(non- preferredname)
Smiles: OC(CC(C(=O)NNC(=S)Nc1ccccc1)Cc1ccccc1)COCCC(C)C

STK526800
Synonyms: methyl6- {(5E)- 5- [3- (6- methoxy- 6- oxohexyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}hexanoate
Smiles: COC(=O)CCCCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCCCC(=O)OC)/C1=O

STK526801
Synonyms: (2R,3R,10bS)- 3- [(4- ethylphenyl)carbonyl]- 2- phenyl- 2,3- dihydropyrrolo[2,1- a]isoquinoline- 1,1(10bH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2ccccc2)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)c1ccc(cc1)CC

STK526802
Synonyms: 1- amino- 5- methyl- N- [3- (trifluoromethyl)phenyl]- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)C)Nc1cccc(c1)C(F)(F)F

STK526804
Synonyms: 3',6'- bis(diethylamino)- 2- (2- methylphenyl)spiro[isoindole- 1,9'- xanthen]- 3(2H)- one
Smiles: CCN(c1ccc2c(c1)Oc1c(C32c2ccccc2C(=O)N3c2ccccc2C)ccc(c1)N(CC)CC)CC

STK526805
Synonyms: 4- (4- fluorophenyl)- 2- {[2- oxo- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]sulfanyl}- 6- phenylpyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)C23CC4CC(C3)CC(C2)C4)nc(cc1c1ccc(cc1)F)c1ccccc1

STK526806
Synonyms: (3Z)- 5- bromo- 3- [(2E)- 2,3,4,9- tetrahydro- 1H- carbazol- 1- ylidenehydrazinylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1ccc2c(c1)/C(=N/N=C/1\CCCc3c1[nH]c1c3cccc1)/C(=O)N2

STK526807
Synonyms: 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3H- benzo[f]chromen- 3- imine
Smiles: Clc1ccc(cc1)c1csc(n1)c1cc2c(oc1=N)ccc1c2cccc1

STK526808
Synonyms: 2- (butylsulfanyl)pyrimidinediium- 4,6- diolate
Smiles: CCCCSc1[nH+]c([O-])cc([nH+]1)[O-]

STK526809
Synonyms: {4- [2- hydroxy- 3- (3- methylphenoxy)propyl]piperazin- 1- yl}(4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)N1CCN(CC1)CC(COc1cccc(c1)C)O

STK526810
Synonyms: ethyl2- {[(8- cyclohexyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetyl]amino}- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCn3c4C2CCCc4c2c3ccc(c2)C2CCCCC2)sc(c1C)C

STK526813
Synonyms: 2- (4- oxo- 3- phenyl- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)- N- phenylhydrazinecarbothioamide
Smiles: S=C(Nc1ccccc1)NNc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3

STK526814
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK526815
Synonyms: 2- {[3- cyano- 4- (2- methoxyphenyl)- 6- phenylpyridin- 2- yl]sulfanyl}- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nc(cc1c1ccccc1OC)c1ccccc1

STK526817
Synonyms: 6- [2- (4- chlorophenyl)- 2- oxoethoxy]- 8- ethyl- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(OCC(=O)c2ccc(cc2)Cl)nc(c2c1CC(C)(C)OC2)CC

STK526819
Synonyms: N~3~- benzyl- N~3~- methyl- beta- alaninamide
Smiles: CN(Cc1ccccc1)CCC(=O)N

STK526820
Synonyms: 3- (2- chloroethyl)- 1- methyl- 6,7- dihydro[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: ClCCn1c(=O)n(C)c2c(c1=O)n1CCSc1n2

STK526821
Synonyms: 6,8- dibromo- 2- imino- N- (2- methoxyphenyl)- 2H- chromene- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1cc2cc(Br)cc(c2oc1=N)Br

STK526822
Synonyms: 2- (4- amino- 3,5- dibromophenyl)- 3a,4,7,7a- tetrahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1C2CC=CCC2C(=O)N1c1cc(Br)c(c(c1)Br)N

STK526823
Synonyms: 2- (3- methylphenoxy)- 2,4,4,6,6,8,8- heptakis(4- methylphenoxy)- 1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~- tetrazatetraphosphocine
Smiles: Cc1ccc(cc1)OP1(=NP(=NP(=NP(=N1)(Oc1ccc(cc1)C)Oc1ccc(cc1)C)(Oc1ccc(cc1)C)Oc1cccc(c1)C)(Oc1ccc(cc1)C)Oc1ccc(cc1)C)Oc1ccc(cc1)C

STK526825
Synonyms: N- [(1E)- 1- (3,4- dimethoxyphenyl)- 3- {(2E)- 2- [(3E)- 4- (furan- 2- yl)but- 3- en- 2- ylidene]hydrazinyl}- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: COc1cc(ccc1OC)/C=C(\C(=O)N/N=C(/C=C/c1ccco1)\C)/NC(=O)c1ccccc1

STK526826
Synonyms: ethyl3- {[(4- cyclohexylpiperazin- 1- yl)acetyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)OC

STK526827
Synonyms: methyl3- ({[4- (2- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cccc2

STK526829
Synonyms: (2E)- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]- 3- {[2- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1C(C)C)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK526830
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 3- (piperidin- 1- ylcarbonyl)quinolin- 4(1H)- one
Smiles: CCn1cc(C(=O)N2CCCCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK526832
Synonyms: 5,5'- [ethane- 1,2- diylbis(imino- 1,3- thiazole- 2,4- diyl)]bis(3- butyl- 5- methyldihydrofuran- 2(3H)- one)
Smiles: CCCCC1CC(OC1=O)(C)c1csc(n1)NCCNc1scc(n1)C1(C)CC(C(=O)O1)CCCC

STK526834
Synonyms: ethyl5- methoxy- 3- [(thiomorpholin- 4- ylacetyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cc(cc2)OC

STK526835
Synonyms: 4- (4- fluorophenyl)piperazine- 1- carbothioamide
Smiles: NC(=S)N1CCN(CC1)c1ccc(cc1)F

STK526836
Synonyms: dimethyl{[(4- methylphenyl)amino](phenyl)methyl}phosphonate
Smiles: COP(=O)(C(c1ccccc1)Nc1ccc(cc1)C)OC

STK526839
Synonyms: ethyl(2E)- 2- (2,4- dichlorobenzylidene)- 7- methyl- 5- (3- nitrophenyl)- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)[N+](=O)[O-])c(=O)/c(=C\c1ccc(cc1Cl)Cl)/s2

STK526840
Synonyms: methyl5- chloro- 3- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK526841
Synonyms: ethyl4- (2,4- dimethoxyphenyl)- 1,6- dimethyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccc(cc1OC)OC

STK526843
Synonyms: 8- bromo- 3- {[(E)- (3- chlorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)Cl

STK526844
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- methylphenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)C)/C#N

STK526845
Synonyms: (3aS,7aR)- 1- methoxy- 3a,4,5,6,7,7a- hexahydro- 1H- benzotriazole2- oxide
Smiles: CON1[N+](=N[C@@H]2[C@H]1CCCC2)[O-]

STK526846
Synonyms: diethyl{[(4- bromophenyl)amino](4- methoxyphenyl)methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1)OC)Nc1ccc(cc1)Br)OCC

STK526847
Synonyms: 2,3,4- tribromo- 6- methoxyaniline
Smiles: COc1cc(Br)c(c(c1N)Br)Br

STK526848
Synonyms: 2- (4- chlorophenyl)- 4- {(2E)- 2- [1- (3,4- dimethoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1cc(ccc1OC)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl)/C

STK526849
Synonyms: 7- (4- nitrophenyl)- 7H- [1,2,3]triazolo[4,5- e][2,1,3]benzoxadiazole3- oxide
Smiles: [O-][N+](=O)c1ccc(cc1)n1nc2c(n1)c1no[n+](c1cc2)[O-]

STK526850
Synonyms: (3S,4S)- 3,4- bis(butylsulfanyl)tetrahydrothiophene1,1- dioxide
Smiles: CCCCS[C@H]1CS(=O)(=O)C[C@@H]1SCCCC

STK526852
Synonyms: 3- {[(E)- (2- chlorophenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1Cl

STK526853
Synonyms: N- (4- phenyl- 1,3- thiazol- 2- yl)- N'- (pyridin- 2- ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1scc(n1)c1ccccc1)NCc1ccccn1

STK526854
Synonyms: ethyl5- methoxy- 3- ({[4- (2- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cc(cc2)OC

STK526855
Synonyms: 2- ethyl- N- [(1Z)- 4,4,7- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1ccc(cc1NC2(C)C)C

STK526856
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(3- bromophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1ccc2c(c1)OCO2

STK526858
Synonyms: N- [(E)- (4- bromophenyl)methylidene]- 9H- carbazol- 3- amine
Smiles: Brc1ccc(cc1)/C=N/c1ccc2c(c1)c1ccccc1[nH]2

STK526860
Synonyms: methyl3- {[(2- ethylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCC1CCCCN1CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK526861
Synonyms: 1- [3- (2,6- dimethoxyphenoxy)- 2- methylpropyl]- 4- methylpiperazine
Smiles: COc1cccc(c1OCC(CN1CCN(CC1)C)C)OC

STK526862
Synonyms: N,N'- bis(4- bromophenyl)- 2- (2'H- spiro[cyclohexane- 1,3'- isoquinolin]- 1'(4'H)- ylidene)propanediamide
Smiles: Brc1ccc(cc1)NC(=O)/C(=C\1/NC2(CCCCC2)Cc2c1cccc2)/C(=O)Nc1ccc(cc1)Br

STK526863
Synonyms: 6- chloro- 3- (hydroxymethyl)- 1,3- benzoxazol- 2(3H)- one
Smiles: OCn1c(=O)oc2c1ccc(c2)Cl

STK526864
Synonyms: 5- acetyl- 4- (4- butoxyphenyl)- 6- methyl- 2- (prop- 2- en- 1- ylsulfanyl)- 1,4- dihydropyridine- 3- carbonitrile
Smiles: CCCCOc1ccc(cc1)C1C(=C(C)NC(=C1C#N)SCC=C)C(=O)C

STK526867
Synonyms: 6- bromo- 2- [(2E)- 2- (1H- indol- 3- ylmethylidene)hydrazinyl]- 4- phenylquinoline
Smiles: Brc1ccc2c(c1)c(cc(n2)N/N=C/c1c[nH]c2c1cccc2)c1ccccc1

STK526868
Synonyms: furan- 2- yl{4- [2- (naphthalen- 1- yloxy)ethyl]piperazin- 1- yl}methanone
Smiles: O=C(c1ccco1)N1CCN(CC1)CCOc1cccc2c1cccc2

STK526870
Synonyms: methyl5- bromo- 3- ({[4- (4- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)Br

STK526872
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- {[2- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccccc1C(C)C)/C#N

STK526877
Synonyms: 2- [2- (3,4- dichlorophenyl)- 9H- imidazo[1,2- a]benzimidazol- 9- yl]- N,N- diethylethanamine
Smiles: CCN(CCn1c2nc(cn2c2c1cccc2)c1ccc(c(c1)Cl)Cl)CC

STK526878
Synonyms: 1,1'- (disulfanediyldiethane- 2,1- diyl)bis(3- naphthalen- 1- ylurea)
Smiles: O=C(Nc1cccc2c1cccc2)NCCSSCCNC(=O)Nc1cccc2c1cccc2

STK526879
Synonyms: 6- amino- 4- (5- nitrothiophen- 2- yl)- 3- propyl- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCc1n[nH]c2c1C(c1ccc(s1)[N+](=O)[O-])C(=C(O2)N)C#N

STK526881
Synonyms: 4- {(2E)- 2- [1- (4- bromophenyl)ethylidene]hydrazinyl}- 2- (4- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C(/c2ccc(cc2)Br)\C)c2c(n1)cccc2

STK526882
Synonyms: 4- [bis(5- methylfuran- 2- yl)methyl]- N- [(E)- (3- nitrophenyl)methylidene]aniline
Smiles: Cc1ccc(o1)C(c1ccc(o1)C)c1ccc(cc1)/N=C/c1cccc(c1)[N+](=O)[O-]

STK526883
Synonyms: N,N'- (hexane- 1,6- diylbis{imino[(1E)- 1- (1,3- benzodioxol- 5- yl)- 3- oxoprop- 1- ene- 3,2- diyl]})dibenzamide
Smiles: O=C(/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)NCCCCCCNC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1

STK526886
Synonyms: ethylN- [(2- ethoxyphenyl)carbonyl]- 3,3,3- trifluoro- 2- (pyridin- 2- ylamino)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1OCC)Nc1ccccn1

STK526887
Synonyms: 8- bromo- 7- [2- hydroxy- 3- (4- iodophenoxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)I

STK526888
Synonyms: 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK526890
Synonyms: 3- imino- 5- (4- methoxyphenyl)- 1- methyl- 7- phenyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccc(cc1)OC)(C(C2(C#N)C#N)c1ccccc1)C

STK526892
Synonyms: 3- (2,6- dimethoxyphenoxy)- N- (furan- 2- ylmethyl)- 2- methylpropan- 1- amine
Smiles: COc1cccc(c1OCC(CNCc1ccco1)C)OC

STK526893
Synonyms: 7- heptyl- 8- [(2- hydroxypropyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(SCC(O)C)nc2c1c(=O)[nH]c(=O)n2C

STK526894
Synonyms: ethyl3- ({[4- (2- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cc(cc2)OC

STK526898
Synonyms: 3- methyl- 7- nonyl- 8- (octylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCSc1nc2c(n1CCCCCCCCC)c(=O)[nH]c(=O)n2C

STK526899
Synonyms: 4- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl]- 2- (3,4- dichlorophenyl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK526900
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(OC)ccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK526901
Synonyms: 4- {(2E)- 2- [1- (pyridin- 3- yl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: C/C(=N\Nc1nc2ccccc2n2c1nnc2)/c1cccnc1

STK526902
Synonyms: 4- ({(E)- 2- cyano- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: CCc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)S(=O)(=O)N)/C#N

STK526903
Synonyms: ethyl4- (nonylamino)- 2- oxo- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC

STK526905
Synonyms: (2E)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK526907
Synonyms: 8- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(N/N=C(/c2ccc(cc2)Cl)\C)nc2c1c(=O)[nH]c(=O)n2C

STK526908
Synonyms: 8- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(=O)[nH]c(=O)n2C

STK526909
Synonyms: 8- (dimethylamino)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)C

STK526910
Synonyms: 4- (7,8- dimethyl- 1,5- dihydro- 2,4- benzodithiepin- 3- yl)- N,N- diethylaniline
Smiles: CCN(c1ccc(cc1)C1SCc2c(CS1)cc(c(c2)C)C)CC

STK526911
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- [(2E)- 2- (1- phenylbutylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCC/C(=N\Nc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C)/c1ccccc1

STK526912
Synonyms: 8- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1cc(/C=N/Nc2nc3c(n2CC(COc2ccccc2C)O)c(=O)[nH]c(=O)n3C)ccc1OC

STK526913
Synonyms: 3- methyl- 8- [(3- methylbutyl)sulfanyl]- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK526914
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- (4- hydroxy- 3- nitrophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])O)/c1scc(n1)c1ccc(cc1Cl)Cl

STK526915
Synonyms: N- {2- [2- (4- methylphenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]ethyl}cyclohexanamine
Smiles: Cc1ccc(cc1)c1cn2c(n1CCNC1CCCCC1)nc1c2cccc1

STK526916
Synonyms: 4- {[(4- iodophenyl)amino](phenyl)methyl}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Ic1ccc(cc1)NC(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1

STK526917
Synonyms: 3- ({5- [4- (2- chlorophenyl)piperazin- 1- yl]- 2,4- dinitrophenyl}amino)benzoicacid
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c(cc1N1CCN(CC1)c1ccccc1Cl)Nc1cccc(c1)C(=O)O

STK526918
Synonyms: 7- (3- bromobenzyl)- 8- hydrazinyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: NNc1nc2c(n1Cc1cccc(c1)Br)c(=O)n(c(=O)n2C)C

STK526919
Synonyms: 1- (2- methyl- 1H- indol- 3- yl)- 2- (thiomorpholin- 4- yl)ethanone
Smiles: O=C(c1c(C)[nH]c2c1cccc2)CN1CCSCC1

STK526923
Synonyms: 2- [bis(4- ethylphenyl)methyl]- 2- nitro- 1H- indene- 1,3(2H)- dione
Smiles: CCc1ccc(cc1)C(C1([N+](=O)[O-])C(=O)c2c(C1=O)cccc2)c1ccc(cc1)CC

STK526925
Synonyms: 3- [(cyclohexylamino)methyl]- 4- methoxybenzaldehyde
Smiles: COc1ccc(cc1CNC1CCCCC1)C=O

STK526926
Synonyms: ethyl2- (4- {[(diethoxyphosphoryl)(4- methoxyphenyl)methyl]amino}- 3- methylphenyl)- 3,3,3- trifluoro- 2- hydroxypropanoate
Smiles: CCOP(=O)(C(c1ccc(cc1)OC)Nc1ccc(cc1C)C(C(F)(F)F)(C(=O)OCC)O)OCC

STK526927
Synonyms: ethyl(2Z)- 2- (1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 5- methyl- 3- oxo- 7- phenyl- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)n2c(=NC1c1ccccc1)s/c(=C\1/c3ccccc3N(C1=O)CC)/c2=O

STK526928
Synonyms: methyl5- bromo- 3- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK526931
Synonyms: 3- methyl- 8- [(4- methylbenzyl)amino]- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(NCc2ccc(cc2)C)nc2c1c(=O)[nH]c(=O)n2C)C

STK526932
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- (3- methylbutyl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCCC(C)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK526934
Synonyms: 4- (4- bromophenyl)- 2- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 6- phenylpyrimidine
Smiles: Brc1ccc(cc1)c1nc(N/N=C/c2ccccc2Cl)nc(c1)c1ccccc1

STK526935
Synonyms: 4- methyl- 2- {[(1Z)- 4,4,8- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]amino}phenol
Smiles: Cc1ccc(c(c1)/N=c/1\ssc2c1c1cc(C)ccc1NC2(C)C)O

STK526936
Synonyms: N,N- diethyl- 3- [2- (4- methylphenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]propan- 1- amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)C)CC

STK526938
Synonyms: 3- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Oc1ccccc1/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK526939
Synonyms: 8- methoxy- 3- {[(E)- pyridin- 2- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccn1

STK526940
Synonyms: 1- methyl- 3- octyl- 9- phenyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccccc1

STK526941
Synonyms: 2,3- dimethyl- 6- (thiophen- 2- yl)imidazo[1,2- b][1,2,4]triazine
Smiles: Cc1nn2cc(nc2nc1C)c1cccs1

STK526942
Synonyms: 6- nitro- 3- (2- phenyl- 1,3- thiazol- 4- yl)- 2H- chromen- 2- one
Smiles: O=c1oc2ccc(cc2cc1c1csc(n1)c1ccccc1)[N+](=O)[O-]

STK526943
Synonyms: 3- (biphenyl- 4- yl)- 5- (furan- 2- yl)- 1- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: c1ccc(cc1)c1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccccc1

STK526945
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 1- (1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: O=C(c1c2ccccc2n(c1C)C)CN1CCN(CC1)Cc1ccccc1

STK526946
Synonyms: 2- (4- cyclohexylpiperazin- 1- yl)- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C1CCCCC1)c(n2C)C

STK526947
Synonyms: 1- heptyl- 4- hydroxy- 2- oxo- N'- [(E)- (2,4,5- trimethoxyphenyl)methylidene]- 1,2- dihydroquinoline- 3- carbohydrazide
Smiles: CCCCCCCn1c(=O)c(C(=O)N/N=C/c2cc(OC)c(cc2OC)OC)c(c2c1cccc2)O

STK526948
Synonyms: 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK526949
Synonyms: 8- methoxy- 3- {[(E)- (2,4,5- trimethoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cc(OC)c(cc1OC)OC

STK526950
Synonyms: N- [4- ({(E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)phenyl]acetamide
Smiles: N#C/C(=C\Nc1ccc(cc1)NC(=O)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK526951
Synonyms: 2- (2,4- dichlorophenyl)- N- (2- methoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccccc1Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK526954
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- N- [5- (2- methylpropyl)- 1,3,4- thiadiazol- 2- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2nnc(s2)CC(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK526955
Synonyms: 4- methyl- N- {4- methyl- 1- oxo- 1- [(tributylstannanyl)oxy]pentan- 2- yl}benzenesulfonamide
Smiles: CCCC[Sn](OC(=O)C(NS(=O)(=O)c1ccc(cc1)C)CC(C)C)(CCCC)CCCC

STK526957
Synonyms: 6- methyl- 2- ({(E)- [1- (4- nitrophenyl)- 1H- pyrrol- 2- yl]methylidene}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])sc2c1CCC(C2)C

STK526958
Synonyms: (2E)- 2- [4- (heptyloxy)benzylidene]- N- [4- (propan- 2- yloxy)benzyl]hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OC(C)C

STK526959
Synonyms: 3- (4- chlorobenzyl)- 1- (2,4- dimethylphenyl)pyrrolidine- 2,5- dione
Smiles: Clc1ccc(cc1)CC1CC(=O)N(C1=O)c1ccc(cc1C)C

STK526960
Synonyms: 3- methyl- 7- (3- methylbenzyl)- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1

STK526961
Synonyms: N'- [(3E)- 1- (azepan- 1- ylmethyl)- 5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- (3,4- dimethoxyphenyl)acetohydrazide
Smiles: COc1ccc(cc1OC)CC(=O)N/N=C\1/C(=O)N(c2c1cc(Br)cc2)CN1CCCCCC1

STK526966
Synonyms: N'- {(3E)- 5- bromo- 1- [(dipropylamino)methyl]- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene}- 2- ({[(E)- (4- methoxyphenyl)methylidene]amino}oxy)acetohydrazide
Smiles: CCCN(CN1c2ccc(cc2/C(=N\NC(=O)CO/N=C/c2ccc(cc2)OC)/C1=O)Br)CCC

STK526967
Synonyms: 2- {2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)c1ccccn1)CN1C(=O)c2c(C1=O)cccc2

STK526971
Synonyms: 3- {[(E)- (3- bromo- 2- hydroxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)Br

STK526973
Synonyms: ethyl5- methoxy- 3- {[(4- oxopiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=O)CC1)cc(cc2)OC

STK526977
Synonyms: ethyl4- {[(diphenoxyphosphoryl)(phenyl)methyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1

STK526979
Synonyms: 2- (4- methoxyphenyl)- 2,3- dihydro- 1H- 1,3,2- benzodiazaphosphole2- oxide
Smiles: COc1ccc(cc1)P1(=O)Nc2c(N1)cccc2

STK526982
Synonyms: 2- (3,4- dichlorophenyl)- N- (4- methylphenyl)quinazolin- 4- amine
Smiles: Cc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK526985
Synonyms: N'- [(E)- (3,4- dimethoxyphenyl)methylidene]- 3- (2- oxopyrrolidin- 1- yl)benzohydrazide
Smiles: COc1ccc(cc1OC)/C=N/NC(=O)c1cccc(c1)N1CCCC1=O

STK526987
Synonyms: (4Z)- 4- [(dimethylamino)methylidene]- 5- oxo- 4,5- dihydrofuran- 2- carbaldehyde
Smiles: O=CC1=C/C(=C/N(C)C)/C(=O)O1

STK526990
Synonyms: 2- {(2E)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}- 3- methylquinoxaline
Smiles: COc1ccc(cc1)/C(=N/Nc1nc2ccccc2nc1C)/C

STK526991
Synonyms: (2E)- 1- (2,4- dimethoxyphenyl)- 3- [(2- hydroxyphenyl)amino]prop- 2- en- 1- one
Smiles: COc1cc(OC)ccc1C(=O)/C=C/Nc1ccccc1O

STK526993
Synonyms: 8- {(2Z)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(=C)Cn1c(N/N=C(\c2ccc(cc2)Cl)/C)nc2c1c(=O)[nH]c(=O)n2C

STK526994
Synonyms: 3- [4- (dimethylamino)benzyl]- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)N(C)C

STK526996
Synonyms: 2- ({6- [(3- hydroxyphenyl)amino]- 7- nitro- 2,1,3- benzoxadiazol- 4- yl}amino)phenol
Smiles: Oc1cccc(c1)Nc1cc(Nc2ccccc2O)c2c(c1[N+](=O)[O-])non2

STK526997
Synonyms: (2Z,3E)- 2- (1- hydroxyethylidene)- 3- [(4- methylphenyl)imino]- 7- nitro- 2,3- dihydro- 1H- inden- 1- one
Smiles: Cc1ccc(cc1)/N=C\1/C(=C(/O)\C)/C(=O)c2c1cccc2[N+](=O)[O-]

STK526998
Synonyms: 8,8'- sulfanediylbis(1,7- dibenzyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione)
Smiles: Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1nc(n2Cc1ccccc1)Sc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK526999
Synonyms: (2,3,5,6- tetrabromobenzene- 1,4- diyl)dimethanol
Smiles: OCc1c(Br)c(Br)c(c(c1Br)Br)CO

STK527001
Synonyms: methyl5- bromo- 3- ({[4- (4- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)Br

STK527003
Synonyms: ethyl3- {[(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cc(c(c3)OC)OC)cc(cc2)F

STK527004
Synonyms: methyl3- {[(4- cyclohexylpiperazin- 1- yl)acetyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)C

STK527007
Synonyms: 3- methyl- 6- [(2E)- 2- (pentafluorobenzylidene)hydrazinyl][1,2,4]triazolo[4,3- b]pyridazine
Smiles: Fc1c(/C=N/Nc2ccc3n(n2)c(C)nn3)c(F)c(c(c1F)F)F

STK527008
Synonyms: 3- [8- (hexylamino)- 3- methyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl]propanenitrile
Smiles: CCCCCCNc1nc2c(n1CCC#N)c(=O)[nH]c(=O)n2C

STK527009
Synonyms: 2,2'- piperazine- 1,4- diylbis(1- phenylethanone)
Smiles: O=C(c1ccccc1)CN1CCN(CC1)CC(=O)c1ccccc1

STK527010
Synonyms: ethyl3- {[(4- cyclohexylpiperazin- 1- yl)acetyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)F

STK527013
Synonyms: (5E)- 1- (2- fluorophenyl)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/C=C/c1ccco1)c1ccccc1F

STK527014
Synonyms: methyl3- ({[4- (4- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)C

STK527015
Synonyms: 3- [4- (dimethylamino)benzyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CN(c1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cccc1)C

STK527017
Synonyms: dimethyl2- {8- methoxy- 2,2- dimethyl- 1- [(3- methylphenyl)carbonyl]- 3- thioxo- 2,3- dihydroquinolin- 4(1H)- ylidene}- 1,3- dithiole- 4,5- dicarboxylate
Smiles: COC(=O)C1=C(S/C(=C\2/c3cccc(c3N(C(C2=S)(C)C)C(=O)c2cccc(c2)C)OC)/S1)C(=O)OC

STK527018
Synonyms: 2,5- bis(tert- butylsulfanyl)thiophene
Smiles: CC(Sc1ccc(s1)SC(C)(C)C)(C)C

STK527019
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 2- ylamino)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccc2)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527024
Synonyms: 2- hydroxy- N'- [(1E)- 1- (2- hydroxyphenyl)ethylidene]- 2,2- bis(2- methoxyphenyl)acetohydrazide
Smiles: COc1ccccc1C(c1ccccc1OC)(C(=O)N/N=C(/c1ccccc1O)\C)O

STK527028
Synonyms: ethyl4,4,5,5- tetracyano- 2- hydroxy- 6- phenylcyclohex- 1- ene- 1- carboxylate
Smiles: CCOC(=O)C1=C(O)CC(C(C1c1ccccc1)(C#N)C#N)(C#N)C#N

STK527029
Synonyms: [(3- benzyl- 2'- nitro- 4'H- spiro[cyclohepta[d][1,3]thiazol- 3- ium- 2,1'- naphthalen]- 4'- ylidene)(oxido)- lambda~5~- azanyl]oxidanide
Smiles: [O-][N+](=C1C=C([N+](=O)[O-])C2(c3c1cccc3)SC1=CC=CC=CC1=[N+]2Cc1ccccc1)[O-]

STK527031
Synonyms: 5- cyano- 2- methyl- 6- (methylsulfanyl)- 4- (3- nitrophenyl)- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SC)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)Nc1ccccc1)C

STK527032
Synonyms: (2E)- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1C)C

STK527034
Synonyms: 8- (butylsulfanyl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527035
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(3- chloro- 4- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(cc1)Br

STK527036
Synonyms: 2- methyl- 4- nitro- 1- (prop- 2- en- 1- yl)- 1H- imidazole
Smiles: [O-][N+](=O)c1cn(c(n1)C)CC=C

STK527039
Synonyms: 2- {(E)- [2- (4- phenyl- 1,3- selenazol- 2- yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccccc1/C=N/Nc1[se]cc(n1)c1ccccc1

STK527040
Synonyms: 8- (dodecylsulfanyl)- 3- methyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK527041
Synonyms: 2- hydroxy- 2,2- diphenyl- N'- [phenyl(thiophen- 2- yl)methyl]acetohydrazide
Smiles: O=C(C(c1ccccc1)(c1ccccc1)O)NNC(c1cccs1)c1ccccc1

STK527042
Synonyms: methyl5- chloro- 3- ({[4- (4- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)Cl

STK527043
Synonyms: (3S,4S)- 3,4- bis(pentylsulfanyl)tetrahydrothiophene1,1- dioxide
Smiles: CCCCCS[C@H]1CS(=O)(=O)C[C@@H]1SCCCCC

STK527044
Synonyms: 6- ({(2E)- 3- phenyl- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}amino)hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccccc1

STK527045
Synonyms: 4,4'- [(4- methoxyphenyl)methanediyl]bis(1- hexyl- 3- methyl- 1H- pyrazol- 5- ol)
Smiles: CCCCCCn1nc(c(c1O)C(c1c(C)nn(c1O)CCCCCC)c1ccc(cc1)OC)C

STK527046
Synonyms: methyl5- bromo- 3- ({[4- (4- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK527047
Synonyms: 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)OC

STK527048
Synonyms: ethyl(2E)- 2- [4- (acetyloxy)- 3- methoxybenzylidene]- 5- [4- (acetyloxy)phenyl]- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C\c1ccc(c(c1)OC)OC(=O)C)/s2

STK527049
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1ccccc1/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK527052
Synonyms: 4- (4- methylpiperazin- 1- yl)[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: CN1CCN(CC1)c1nc2ccccc2n2c1nnc2

STK527053
Synonyms: 4- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 1- oxaspiro[4.5]decan- 2- one
Smiles: O=C1CC(C2(O1)CCCCC2)c1scc(n1)c1ccc(cc1)Cl

STK527054
Synonyms: 4- (3- benzylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (pyridin- 4- ylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccncc1)[n+]1cccc(c1)Cc1ccccc1

STK527055
Synonyms: N- (4- nitrophenyl)- 2- (5- oxo- 4- pentyltetrahydrofuran- 2- yl)acetamide
Smiles: CCCCCC1CC(OC1=O)CC(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK527056
Synonyms: N- [(4- nitrophenyl)sulfanyl]- 1,1- bis[4- (trifluoromethyl)phenyl]methanimine
Smiles: [O-][N+](=O)c1ccc(cc1)S/N=C(/c1ccc(cc1)C(F)(F)F)\c1ccc(cc1)C(F)(F)F

STK527057
Synonyms: ethyl3- [(3,4- dihydroisoquinolin- 2(1H)- ylacetyl)amino]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)OC

STK527058
Synonyms: 7- benzyl- 3- methyl- 8- (octylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK527059
Synonyms: 2- {[(2- hydroxyethyl)amino]methyl}tricyclo[3.3.1.1~3,7~]decan- 2- ol
Smiles: OCCNCC1(O)C2CC3CC1CC(C2)C3

STK527060
Synonyms: 10- (pyridin- 2- ylmethyl)decahydroacridine- 4a,10a(2H,10H)- dicarbonitrile
Smiles: N#CC12CCCCC1CC1C(N2Cc2ccccn2)(C#N)CCCC1

STK527061
Synonyms: 8- methyl- 3- {[(E)- pyridin- 3- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccnc1

STK527062
Synonyms: 2- {2- [2- (pyridin- 3- yl)piperidin- 1- yl]ethyl}- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: C1CCN(C(C1)c1cccnc1)CCc1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK527063
Synonyms: (2Z)- 2- (4- nitrobenzylidene)- 6,7- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 3(2H)- one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=c/1\sc2=NCCCn2c1=O

STK527064
Synonyms: 8- bromo- 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527069
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- (2- fluorophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1F)/c1scc(n1)c1ccc(cc1Cl)Cl

STK527070
Synonyms: 6- (4- bromophenyl)- 2,3- dimethylimidazo[1,2- b][1,2,4]triazine
Smiles: Brc1ccc(cc1)c1cn2c(n1)nc(c(n2)C)C

STK527072
Synonyms: 2- [4- (dimethylamino)phenyl]- 3- (4- methoxyphenyl)- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: COc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(cc1)N(C)C

STK527073
Synonyms: methylN- [(2,4- dichlorophenyl)carbonyl]- 2- {[4- (3- ethoxy- 1,1,1- trifluoro- 2- hydroxy- 3- oxopropan- 2- yl)phenyl]amino}- 3,3,3- trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1Cl)Cl)O

STK527075
Synonyms: 2- (2,4- dichlorophenyl)- 4- [4- (diphenylmethyl)piperazin- 1- yl]quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)cccc2

STK527076
Synonyms: N- (1,3- benzothiazol- 2- yl)- 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2nc3c(s2)cccc3)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527077
Synonyms: 3- (3- chlorophenyl)- 1- (4- chlorophenyl)- 1- (5- methyl- 4,5- dihydro- 1,3- thiazol- 2- yl)urea
Smiles: CC1CN=C(S1)N(c1ccc(cc1)Cl)C(=O)Nc1cccc(c1)Cl

STK527078
Synonyms: 9- (3,4- dihydroxyphenyl)- 3,6- diphenyl- 3,4,5,6,7,9- hexahydro- 1H- xanthene- 1,8(2H)- dione
Smiles: O=C1CC(CC2=C1C(c1ccc(c(c1)O)O)C1=C(O2)CC(CC1=O)c1ccccc1)c1ccccc1

STK527079
Synonyms: 2- {3- [(2,3- dimethylphenoxy)methyl]- 4- methoxyphenyl}- 3- (2- fluorophenyl)- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: COc1ccc(cc1COc1cccc(c1C)C)C1Nc2ccccc2C(=O)N1c1ccccc1F

STK527082
Synonyms: ethyl1- (4- bromophenyl)- 4,6- diphenyl- 1,4- dihydro- 1,2,4- diazaphosphinine- 3- carboxylate4- sulfide
Smiles: CCOC(=O)C1=NN(c2ccc(cc2)Br)C(=CP1(=S)c1ccccc1)c1ccccc1

STK527085
Synonyms: 4- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 2- (2,4- dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)/C

STK527086
Synonyms: 2,2',2''- methanetriyltris[5- (3- chlorophenyl)furan]
Smiles: Clc1cccc(c1)c1ccc(o1)C(c1ccc(o1)c1cccc(c1)Cl)c1ccc(o1)c1cccc(c1)Cl

STK527087
Synonyms: 1- {(E)- [2- (4,6- diphenylpyrimidin- 2- yl)hydrazinylidene]methyl}naphthalen- 2- ol
Smiles: Oc1ccc2c(c1/C=N/Nc1nc(cc(n1)c1ccccc1)c1ccccc1)cccc2

STK527088
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 8- (propan- 2- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK527089
Synonyms: 3- (7- hydroxy- 1- methyl- 2,4- dioxo- 9- phenyl- 1,4,6,7,8,9- hexahydropyrimido[2,1- f]purin- 3(2H)- yl)propanenitrile
Smiles: N#CCCn1c(=O)n(C)c2c(c1=O)n1CC(O)CN(c1n2)c1ccccc1

STK527090
Synonyms: 1- (cyclopropylcarbonyl)- 2- (3- nitrophenyl)- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)C(c2cccc(c2)[N+](=O)[O-])C(N2C1C=Cc1c2cccc1)C(=O)C1CC1

STK527091
Synonyms: 2- ({4- [2,4- bis(2- methylbutan- 2- yl)phenoxy]butyl}amino)- 4- (4- nitrophenoxy)naphthalen- 1- ol
Smiles: CCC(c1cc(ccc1OCCCCNc1cc(Oc2ccc(cc2)[N+](=O)[O-])c2c(c1O)cccc2)C(CC)(C)C)(C)C

STK527093
Synonyms: 3- (pyridin- 2- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccccn1

STK527095
Synonyms: methyl3- ({[4- (diphenylmethyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)cccc2

STK527097
Synonyms: (5Z)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)- 1- (2,4,6- trimethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)NC(=O)/C(=C/NN2CCCCC2c2cccnc2)/C1=O

STK527101
Synonyms: 7- decyl- 3- methyl- 8- [(2- oxo- 2- phenylethyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK527105
Synonyms: 2- (4- chlorophenyl)- 4- [(2E)- 2- (1- phenylethylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C(/c2ccccc2)\C)c2c(n1)cccc2

STK527106
Synonyms: 1- (2- methyl- 1H- indol- 3- yl)- 2- (2- methylpiperidin- 1- yl)ethanone
Smiles: CC1CCCCN1CC(=O)c1c(C)[nH]c2c1cccc2

STK527107
Synonyms: 8- bromo- 3- {[(E)- (4- chlorophenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527108
Synonyms: 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527110
Synonyms: 5- [(E)- {2- [3- (9H- carbazol- 9- yl)propanoyl]hydrazinylidene}methyl]- 4- (4- methylpyridinium- 1- yl)- 2- oxo- 1,3- thiazol- 3- ide
Smiles: O=C(CCn1c2ccccc2c2c1cccc2)N/N=C/c1sc(=O)[n-]c1[n+]1ccc(cc1)C

STK527112
Synonyms: 1- phenyl- 4- [(2,4,6- trichlorophenoxy)methyl]- 1H- 1,2,3- triazole
Smiles: Clc1cc(Cl)c(c(c1)Cl)OCc1nnn(c1)c1ccccc1

STK527116
Synonyms: 3,4- dichloro- 1- {2- oxo- 2- [(tributylstannanyl)oxy]ethyl}- 1H- pyrrole- 2,5- dione
Smiles: CCCC[Sn](OC(=O)CN1C(=O)C(=C(C1=O)Cl)Cl)(CCCC)CCCC

STK527119
Synonyms: methyl(8- methyl- 4- oxo- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- yl)acetate
Smiles: COC(=O)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527121
Synonyms: methyl5- methyl- 3- ({[4- (4- nitrobenzyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-])cc(cc2)C

STK527122
Synonyms: 8- (dodecylsulfanyl)- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK527123
Synonyms: 8- bromo- 3- ({(E)- [2- hydroxy- 3- (prop- 2- en- 1- yl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527124
Synonyms: 4- (3,3- dimethylpiperidin- 1- yl)- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC(C1)(C)C

STK527125
Synonyms: N- (6- methyl- 1,3- benzothiazol- 2- yl)- N'- (propan- 2- yl)butanediamide
Smiles: CC(NC(=O)CCC(=O)Nc1nc2c(s1)cc(cc2)C)C

STK527128
Synonyms: 1- (2- methoxyphenyl)- 4- {2- [2- (naphthalen- 1- yloxy)ethoxy]ethyl}piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCOCCOc1cccc2c1cccc2

STK527129
Synonyms: ethyl(2E)- 7- methyl- 3- oxo- 5- [(E)- 2- phenylethenyl]- 2- [(2Z)- 3- phenylprop- 2- en- 1- ylidene]- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1/C=C/c1ccccc1)c(=O)/c(=C\C=C/c1ccccc1)/s2

STK527132
Synonyms: 3- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527134
Synonyms: 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(c(c1)O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527135
Synonyms: 3- chloro- N- [(1Z)- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]- 4- methylaniline
Smiles: Cc1ccc(cc1Cl)/N=c/1\ssc2c1c1ccccc1NC2(C)C

STK527136
Synonyms: 4- hydroxy- N- [4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]- 2- oxo- 1- propyl- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCn1c(=O)c(C(=O)Nc2ccc(cc2)c2sc3c(n2)ccc(c3)C)c(c2c1cccc2)O

STK527138
Synonyms: 4- hydroxy- 1- methyl- N- [4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK527141
Synonyms: ethyl3- {[(4- ethylpiperazin- 1- yl)acetyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)CC)cc(cc2)F

STK527142
Synonyms: (2Z)- 3- [(2,5- dimethylphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK527143
Synonyms: N- [(E)- {3- [(3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)methyl]- 4- methoxyphenyl}methylidene]- 4H- 1,2,4- triazol- 3- amine
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)/C=N/c1nnc[nH]1

STK527144
Synonyms: 2- chloro- 6,7- dihydro- 5H- cyclopenta[b]pyridine- 3,4- dicarbonitrile
Smiles: N#Cc1c(C#N)c(Cl)nc2c1CCC2

STK527147
Synonyms: 5- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 6- hydroxy- 3- phenyl- 2- (prop- 2- en- 1- ylsulfanyl)pyrimidin- 4(3H)- one
Smiles: C=CCSc1nc(O)c(c(=O)n1c1ccccc1)C1OC(=O)c2c1ccc(c2OC)OC

STK527148
Synonyms: N- {(2E)- 3- (3- nitrophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}glycine
Smiles: OC(=O)CNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

STK527151
Synonyms: 4- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 2- (4- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527153
Synonyms: 9- (1- butoxyethyl)- 3- nitro- 9H- carbazole
Smiles: CCCCOC(n1c2ccc(cc2c2c1cccc2)[N+](=O)[O-])C

STK527154
Synonyms: 8- methoxy- 3- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C(C)C

STK527155
Synonyms: 3- methyl- 7- (3- phenylpropyl)- 8- [(3- phenylpropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCCc1ccccc1)SCCCc1ccccc1

STK527156
Synonyms: (5E)- 1- (2- methoxyphenyl)- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1N1C(=O)NC(=O)/C(=C\C=C\c2ccccc2)/C1=O

STK527157
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(2- methoxyethyl)amino]propan- 2- yl}acetamide
Smiles: COCCNC(C(F)(F)F)(C(F)(F)F)NC(=O)C

STK527158
Synonyms: 3- bromo- 1- {(E)- [(5- methylpyridin- 2- yl)imino]methyl}- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 2- ol
Smiles: Cc1ccc(nc1)/N=C/c1c(O)c(Br)cc2c1c1CCCCc1o2

STK527159
Synonyms: methyl3- {[N- (1,3- benzodioxol- 5- yl)- N- ethylglycyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCN(c1ccc2c(c1)OCO2)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK527160
Synonyms: 3- chloro- 7- [(4- methylphenyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc(cc1)Nc1cc2oc3cc(Cl)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK527163
Synonyms: propyl[(3- cyano- 4,6- diphenylpyridin- 2- yl)sulfanyl]acetate
Smiles: CCCOC(=O)CSc1nc(cc(c1C#N)c1ccccc1)c1ccccc1

STK527165
Synonyms: 4- [nitroso(phenyl)amino]phenylacetate
Smiles: O=NN(c1ccccc1)c1ccc(cc1)OC(=O)C

STK527166
Synonyms: 2- [2- hydroxy- 3- (3- methylbutoxy)propyl]propanediamide
Smiles: OC(CC(C(=O)N)C(=O)N)COCCC(C)C

STK527167
Synonyms: 2,7- bis(azepan- 1- ylmethyl)- 1,8- bis(4- methoxyphenyl)octane- 1,8- dione
Smiles: COc1ccc(cc1)C(=O)C(CN1CCCCCC1)CCCCC(C(=O)c1ccc(cc1)OC)CN1CCCCCC1

STK527168
Synonyms: (5Z)- 1- (naphthalen- 1- yl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\NN1CCCCC1c1cccnc1)c1cccc2c1cccc2

STK527169
Synonyms: 3- methyl- 7- pentyl- 8- (propylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(SCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527170
Synonyms: 1- (5- methoxy- 1H- indol- 3- yl)- 2- (piperidin- 1- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCCCC1

STK527171
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- (4- ethylpiperazin- 1- yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c(C)n(c2c1cccc2)C

STK527172
Synonyms: 2- oxo- 2H- chromen- 4- yl(2- nitrophenyl)acetate
Smiles: O=C(Cc1ccccc1[N+](=O)[O-])Oc1cc(=O)oc2c1cccc2

STK527173
Synonyms: 2- (4- chlorophenyl)- 4- (2- methylphenoxy)quinazoline
Smiles: Clc1ccc(cc1)c1nc(Oc2ccccc2C)c2c(n1)cccc2

STK527174
Synonyms: 1- [5- (bromomethyl)- 5- methyl- 4,5- dihydro- 1,3- thiazol- 2- yl]- 1- (4- methylphenyl)- 3- phenylurea
Smiles: BrCC1(C)CN=C(S1)N(C(=O)Nc1ccccc1)c1ccc(cc1)C

STK527175
Synonyms: N- butyl- 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527176
Synonyms: (2E)- 2- cyano- N- [2- (dimethylamino)ethyl]- 3- [5- (4- methylphenyl)furan- 2- yl]prop- 2- enamide
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1)C)/C(=O)NCCN(C)C

STK527178
Synonyms: 3- (furan- 2- ylmethyl)- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccco1

STK527179
Synonyms: N- [(1E)- 3- oxo- 1- phenyl- 3- {[6- ({(2Z)- 3- phenyl- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}amino)hexyl]amino}prop- 1- en- 2- yl]benzamide
Smiles: O=C(/C(=C/c1ccccc1)/NC(=O)c1ccccc1)NCCCCCCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccccc1

STK527181
Synonyms: 2- [4- (4- chlorophenyl)piperazin- 1- yl]- 1- (1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: Clc1ccc(cc1)N1CCN(CC1)CC(=O)c1c(C)n(c2c1cccc2)C

STK527182
Synonyms: 3- (furan- 2- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccco1

STK527183
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- [4- (2,3- dimethylphenyl)piperazin- 1- yl]ethanone
Smiles: Cc1c(C)cccc1N1CCN(CC1)CC(=O)c1c2ccccc2n(c1C)C

STK527185
Synonyms: 4- (morpholin- 4- yl)[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: O1CCN(CC1)c1nc2ccccc2n2c1nnc2

STK527187
Synonyms: ethyl3- [(E)- (4- carbamoylpiperidin- 1- yl)diazenyl]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CC[C@H](CC1)C(=O)N)cc(cc2)OC

STK527189
Synonyms: methyl5- bromo- 3- {[(4- cyclohexylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)Br

STK527190
Synonyms: N- ({2- [(difluoromethyl)sulfanyl]phenyl}carbamoyl)- 2,6- difluorobenzamide
Smiles: O=C(Nc1ccccc1SC(F)F)NC(=O)c1c(F)cccc1F

STK527191
Synonyms: N- [(E)- (3- {[4- chloro- 5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 4- methoxyphenyl)methylidene]morpholin- 4- amine
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)/C=N/N1CCOCC1

STK527192
Synonyms: 2- {[(E)- 1H- indol- 3- ylmethylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2c[nH]c3c2cccc3)sc2c1CCN(C2)C

STK527193
Synonyms: 2- {(E)- [(5- methylpyridin- 2- yl)imino]methyl}- 4- nitronaphthalen- 1- ol
Smiles: Cc1ccc(nc1)/N=C/c1cc([N+](=O)[O-])c2c(c1O)cccc2

STK527194
Synonyms: 6- (4- fluorophenoxy)- N- (furan- 2- ylmethyl)hexan- 1- amine
Smiles: Fc1ccc(cc1)OCCCCCCNCc1ccco1

STK527195
Synonyms: 1- (2- methoxyethyl)- 1- (2- methylphenyl)- 3- phenylurea
Smiles: COCCN(c1ccccc1C)C(=O)Nc1ccccc1

STK527199
Synonyms: N,N- diethyl- 2- {2- imino- 3- [(octyloxy)methyl]- 2,3- dihydro- 1H- benzimidazol- 1- yl}ethanamine
Smiles: CCCCCCCCOCn1c2ccccc2n(c1=N)CCN(CC)CC

STK527200
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- (5- nitro- 1,3- thiazol- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2ncc(s2)[N+](=O)[O-])c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527201
Synonyms: N- (4- bromophenyl)- 4- ethoxy- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1ccc(cc1)Br)C

STK527202
Synonyms: 1- chloro- 3- {[(2Z)- 3- phenyl- 1,3- benzothiazol- 2(3H)- ylidene]amino}propan- 2- ol
Smiles: ClCC(C/N=c/1\sc2c(n1c1ccccc1)cccc2)O

STK527203
Synonyms: (2E,2'E)- 3,3'- [methanediylbis(benzene- 4,1- diylimino)]bis[1- (2,4- dimethoxyphenyl)prop- 2- en- 1- one]
Smiles: COc1cc(OC)ccc1C(=O)/C=C/Nc1ccc(cc1)Cc1ccc(cc1)N/C=C/C(=O)c1ccc(cc1OC)OC

STK527204
Synonyms: 2- (4- amino- 3,5- dibromophenyl)- 1,3- dioxo- 2,3- dihydro- 1H- isoindole- 5- carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cc(Br)c(c(c1)Br)N

STK527206
Synonyms: 2,6- difluoro- N- ({3- [(heptafluoropropyl)sulfanyl]phenyl}carbamoyl)benzamide
Smiles: O=C(NC(=O)c1c(F)cccc1F)Nc1cccc(c1)SC(C(C(F)(F)F)(F)F)(F)F

STK527207
Synonyms: 8- (butan- 2- ylsulfanyl)- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SC(CC)C)nc2c1c(=O)[nH]c(=O)n2C

STK527208
Synonyms: [(7- hexadecyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]aceticacid
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK527209
Synonyms: N'- [(1E)- 1- (6- methoxy- 2- oxo- 2H- chromen- 3- yl)ethylidene]pyridine- 4- carbohydrazide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccncc1)/C

STK527210
Synonyms: 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK527211
Synonyms: N- (2,4- dichlorophenyl)- 2- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527212
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(4- ethoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc2c(c1)OCO2)\C#N

STK527213
Synonyms: 1- (benzyloxy)- 3- (morpholin- 4- yl)propan- 2- ylphenylacetate
Smiles: O=C(Cc1ccccc1)OC(CN1CCOCC1)COCc1ccccc1

STK527215
Synonyms: ethyl3- [(E)- 3,4- dihydroisoquinolin- 2(1H)- yldiazenyl]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCc3c(C1)cccc3)cc(cc2)OC

STK527218
Synonyms: 1- methyl- 7- (pyrrolidin- 1- yl)- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2c(cc3c(c2c(=O)c2c1cccc2)[nH]c1c(o3)cccc1C)N1CCCC1

STK527219
Synonyms: tetramethyl6'- [(4- methoxyphenyl)carbonyl]- 5',5',7'- trimethyl- 5',6'- dihydrospiro[1,3- dithiole- 2,1'- thiopyrano[2,3- c]quinoline]- 2',3',4,5- tetracarboxylate
Smiles: COc1ccc(cc1)C(=O)N1c2c(C)cccc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

STK527220
Synonyms: 4- ethoxy- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)- N,N- dipentylbenzenesulfonamide
Smiles: CCCCCN(S(=O)(=O)c1ccc(c(c1)c1[nH]c(=O)c2c(n1)c(CCC)nn2C)OCC)CCCCC

STK527221
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 8- (heptylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCSc1nc2c(n1C/C=C/C)c(=O)[nH]c(=O)n2C

STK527223
Synonyms: 3- [2- (4- bromophenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]- N,N- diethylpropan- 1- amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br)CC

STK527225
Synonyms: 3- {[(E)- (2- chlorophenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1Cl

STK527226
Synonyms: 6,6'- (butane- 1,4- diyldisulfanediyl)bis[4- (4- butoxyphenyl)- 5- cyano- 2- methyl- N- phenylpyridine- 3- carboxamide]
Smiles: CCCCOc1ccc(cc1)c1c(C#N)c(SCCCCSc2nc(C)c(c(c2C#N)c2ccc(cc2)OCCCC)C(=O)Nc2ccccc2)nc(c1C(=O)Nc1ccccc1)C

STK527227
Synonyms: methyl3- [({4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}acetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C/C=C/c1ccccc1)cccc2

STK527228
Synonyms: 4- ethoxy- N- [(E)- furan- 2- ylmethylidene]aniline
Smiles: CCOc1ccc(cc1)/N=C/c1ccco1

STK527229
Synonyms: 1- naphthalen- 1- yl- 3- (4- phenylquinolin- 8- yl)urea
Smiles: O=C(Nc1cccc2c1cccc2)Nc1cccc2c1nccc2c1ccccc1

STK527231
Synonyms: N- (3- chlorophenyl)- 2- (4- chlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2cccc(c2)Cl)c2c(n1)cccc2

STK527232
Synonyms: 7- bromo- 6- methyl- 2,3- diphenyl- 7H- imidazo[1,2- b][1,2,4]triazepin- 8(9H)- one
Smiles: O=C1Nc2nc(c(n2N=C(C1Br)C)c1ccccc1)c1ccccc1

STK527233
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 4- hydroxy- 2- oxo- 1- (prop- 2- en- 1- yl)- 1,2- dihydroquinoline- 3- carboxamide
Smiles: C=CCn1c(=O)c(C(=O)NCc2ccc3c(c2)OCO3)c(c2c1cccc2)O

STK527237
Synonyms: methyl3- amino- 4- (2- methoxyphenyl)- 6- phenylthieno[2,3- b]pyridine- 2- carboxylate
Smiles: COc1ccccc1c1cc(nc2c1c(N)c(s2)C(=O)OC)c1ccccc1

STK527239
Synonyms: 3- methyl- 7- octyl- 8- (prop- 2- en- 1- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCC=C)nc2c1c(=O)[nH]c(=O)n2C

STK527240
Synonyms: 2- (2- chlorophenyl)- 4- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C

STK527241
Synonyms: N- [(4- ethoxyphenyl)carbonyl]glycylglycine
Smiles: CCOc1ccc(cc1)C(=O)NCC(=O)NCC(=O)O

STK527242
Synonyms: 2- amino- 4- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 6- (methylsulfanyl)pyrimidine- 5- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)Br)nc(nc1SC)N

STK527243
Synonyms: 3- [(3- methyl- 7- nonyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]propanoicacid
Smiles: CCCCCCCCCn1c(SCCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK527245
Synonyms: ethyl3- {[(3,3- dimethylpiperidin- 1- yl)acetyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)(C)C)cc(cc2)OC

STK527247
Synonyms: 7- hexadecyl- 3- methyl- 8- (propan- 2- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK527249
Synonyms: ethyl(6- bromo- 2- oxo- 1,3- benzoxazol- 3(2H)- yl)acetate
Smiles: CCOC(=O)Cn1c(=O)oc2c1ccc(c2)Br

STK527250
Synonyms: 3- (3- bromophenyl)- 2- (3,4,5- trimethoxyphenyl)- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: COc1c(OC)cc(cc1OC)C1Nc2ccccc2C(=O)N1c1cccc(c1)Br

STK527251
Synonyms: N- {4- tert- butyl- 1- [1- (2- methylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- 3- methyl- N- nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1ccccc1C)c1cccc(c1)C

STK527252
Synonyms: N- decyl- 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527253
Synonyms: N- [2- (difluoromethoxy)phenyl]- 2,2,3,3,4,4,4- heptafluorobutanamide
Smiles: FC(Oc1ccccc1NC(=O)C(C(C(F)(F)F)(F)F)(F)F)F

STK527254
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- N- propyl- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK527258
Synonyms: 3- methyl- 8- (methylsulfanyl)- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SC)nc2c1c(=O)[nH]c(=O)n2C

STK527261
Synonyms: 1- ethyl- 6- fluoro- N- (2- fluorobenzyl)- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccc2F)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527263
Synonyms: N,N'- di- tert- butyl- 1,5- dimethyl- 9- oxo- 3,7- diazabicyclo[3.3.1]nonane- 3,7- dicarbothioamide
Smiles: S=C(N1CC2(C)CN(CC(C1)(C2=O)C)C(=S)NC(C)(C)C)NC(C)(C)C

STK527266
Synonyms: dimethyl[(3,4- dichlorophenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1ccc(c(c1)Cl)Cl)Nc1ccccc1)OC

STK527268
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (3- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK527272
Synonyms: N- (4- methoxybenzyl)- N- [4- (9H- thioxanthen- 9- yl)phenyl]morpholine- 4- carboxamide
Smiles: COc1ccc(cc1)CN(C(=O)N1CCOCC1)c1ccc(cc1)C1c2ccccc2Sc2c1cccc2

STK527273
Synonyms: 3- ({(E)- [3- (hydroxymethyl)- 4- methoxyphenyl]methylidene}amino)- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)CO)OC

STK527275
Synonyms: 4,4'- propane- 1,1- diylbis(1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one)
Smiles: CCC(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C

STK527276
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 8- {(2Z)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C

STK527277
Synonyms: 2- ({[(E)- (2- chlorophenyl)methylidene]amino}oxy)- N'- [(3E)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]acetohydrazide
Smiles: O=C(N/N=C\1/C(=O)Nc2c1cccc2)CO/N=C/c1ccccc1Cl

STK527278
Synonyms: 4- (4- tert- butylpyridinium- 1- yl)- 5- [(E)- (2- carbamothioylhydrazinylidene)methyl]- 2- oxo- 1,3- thiazol- 3- ide
Smiles: NC(=S)N/N=C/c1sc(=O)[n-]c1[n+]1ccc(cc1)C(C)(C)C

STK527280
Synonyms: 4- [(8- methyl- 4- oxo- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- yl)methyl]benzonitrile
Smiles: N#Cc1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527281
Synonyms: 2- ({(E)- [1- (4- nitrophenyl)- 1H- pyrrol- 2- yl]methylidene}amino)- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])sc2c1CCC2

STK527282
Synonyms: 4- [(E)- (4- hydroxy- 3- {[(tributylstannanyl)oxy]carbonyl}phenyl)diazenyl]- N- (pyridin- 2- yl)benzenesulfonamide
Smiles: CCCC[Sn](OC(=O)c1cc(/N=N/c2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O)(CCCC)CCCC

STK527283
Synonyms: 4- [2- amino- 3- cyano- 6- methyl- 4,4- bis(trifluoromethyl)pyridin- 1(4H)- yl]benzenesulfonamide
Smiles: N#CC1=C(N)N(C(=CC1(C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)S(=O)(=O)N

STK527284
Synonyms: N- [3- (dimethylamino)propyl]- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCCCN(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527286
Synonyms: (4Z)- 4- [(morpholin- 4- ylamino)methylidene]- 2- phenyl- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\NN1CCOCC1)c1ccccc1

STK527288
Synonyms: 2- [4- (9H- fluoren- 9- yl)piperazin- 1- yl]- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)c(n2C)C

STK527289
Synonyms: 2- {[(E)- 1H- benzimidazol- 2- ylmethylidene]amino}- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2nc3c([nH]2)cccc3)sc2c1CCC(C2)C

STK527290
Synonyms: 3- {[(E)- (2,4- dimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(c(c1)OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527291
Synonyms: N'- [(E)- biphenyl- 3- ylmethylidene]- 2- bromobenzohydrazide
Smiles: O=C(c1ccccc1Br)N/N=C/c1cccc(c1)c1ccccc1

STK527292
Synonyms: 3- {[(E)- (2- chlorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527293
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C)C

STK527294
Synonyms: 6- bromo- 2- {(2Z)- 2- [1- (1- methyl- 1H- benzimidazol- 2- yl)ethylidene]hydrazinyl}- 4- phenylquinazoline
Smiles: Brc1ccc2c(c1)c(nc(n2)N/N=C(\c1nc2c(n1C)cccc2)/C)c1ccccc1

STK527297
Synonyms: methyl3- {[2- (3,4- dichlorophenyl)quinazolin- 4- yl]amino}benzoate
Smiles: COC(=O)c1cccc(c1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527298
Synonyms: 2- (4- chlorophenyl)- 4- [4- (diphenylmethyl)piperazin- 1- yl]quinazoline
Smiles: Clc1ccc(cc1)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)cccc2

STK527299
Synonyms: 3- [2- (pyrrolidin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(CCN2CCCC2)cnc2c1[nH]c1c2cccc1

STK527300
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- (3- methylpyridin- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2ncccc2C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527301
Synonyms: 1a,2a,3,6,6a,7a- hexahydro- 3,6- methanonaphtho[2,3- b]oxirene- 2,7- dione
Smiles: O=C1C2C3C=CC(C2C(=O)C2C1O2)C3

STK527302
Synonyms: 8- methyl- 3- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(/C=N/n2cnc3c(c2=O)[nH]c2c3cc(cc2)C)cc(c1OC)OC

STK527303
Synonyms: 1- (1H- indol- 3- yl)- 2- (4- phenylpiperazin- 1- yl)ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCN(CC1)c1ccccc1

STK527304
Synonyms: methyl5- methyl- 3- {[3- (4- phenylpiperazin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cc(cc2)C

STK527305
Synonyms: methyl3- ({[4- (4- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cccc2

STK527306
Synonyms: N- {2- [(3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 4- methoxybenzamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccc(cc1)OC

STK527308
Synonyms: 7- (butan- 2- yl)- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCC(n1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C)C

STK527309
Synonyms: 2- [3- (2- chlorobenzyl)- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl]- 1- (3,4- dichlorophenyl)ethanol
Smiles: OC(c1ccc(c(c1)Cl)Cl)Cn1c2ccccc2n(c1=N)Cc1ccccc1Cl

STK527311
Synonyms: diethyl(pentabromobenzyl)propanedioate
Smiles: CCOC(=O)C(C(=O)OCC)Cc1c(Br)c(Br)c(c(c1Br)Br)Br

STK527312
Synonyms: methyl4- [(3,5- di- tert- butyl- 4- oxocyclohexa- 2,5- dien- 1- ylidene)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C/1\C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C

STK527314
Synonyms: 3- methyl- N- (propan- 2- yl)[1,2,4]triazolo[4,3- b]pyridazin- 6- amine
Smiles: CC(Nc1ccc2n(n1)c(C)nn2)C

STK527316
Synonyms: N- {4- [(2- methoxy- 5- {(E)- [(8- methoxy- 4- oxo- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- yl)imino]methyl}benzyl)oxy]phenyl}acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK527317
Synonyms: 8- (butylsulfanyl)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527320
Synonyms: (5Z)- 5- (2,4- dimethoxybenzylidene)- 1- (naphthalen- 1- yl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(c(c1)OC)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc2c1cccc2

STK527321
Synonyms: 1,7- dibenzyl- 8- [(2E)- 2- (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1ccc2c(c1)/C(=N\Nc1nc3c(n1Cc1ccccc1)c(=O)n(c(=O)n3C)Cc1ccccc1)/C(=O)N2

STK527322
Synonyms: ethyl6- fluoro- 1- heptyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCCn1cc(C(=O)OCC)c(=O)c2c1ccc(c2)F

STK527325
Synonyms: ethyl(2E)- 2- [2- (acetyloxy)- 5- bromobenzylidene]- 7- methyl- 3- oxo- 5- phenyl- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C\c1cc(Br)ccc1OC(=O)C)/s2

STK527326
Synonyms: methyl3- ({[4- (2- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cccc2

STK527327
Synonyms: 8- bromo- 3- (pyridin- 3- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1cccnc1

STK527328
Synonyms: diethyl(3- bromo- 6- oxo- 6H- anthra[1,9- cd][1,2]oxazol- 5- yl)propanedioate
Smiles: CCOC(=O)C(c1cc(Br)c2c3c1C(=O)c1ccccc1c3on2)C(=O)OCC

STK527329
Synonyms: N- octyl- 2- (phenylamino)pyridine- 3- carboxamide
Smiles: CCCCCCCCNC(=O)c1cccnc1Nc1ccccc1

STK527330
Synonyms: 4- butoxy- N- [(1E)- 3- hydrazinyl- 1- (4- methoxyphenyl)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: CCCCOc1ccc(cc1)C(=O)N/C(=C/c1ccc(cc1)OC)/C(=O)NN

STK527331
Synonyms: 8- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 7- [(2Z)- 3- chlorobut- 2- en- 1- yl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C(=C/Cn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(=O)[nH]c(=O)n2C)/Cl

STK527332
Synonyms: N'- [3- methyl- 7- (2- methylpropyl)- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]formichydrazide
Smiles: O=CNNc1nc2c(n1CC(C)C)c(=O)[nH]c(=O)n2C

STK527334
Synonyms: ethyl3,3,3- trifluoro- 2- [(4- methylphenyl)amino]- N- (phenylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1ccc(cc1)C

STK527335
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (3,3- dimethylpiperidin- 1- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCCC(C1)(C)C)c(n2Cc1ccccc1)C

STK527336
Synonyms: (2Z,7Z)- 2,7- bis[(5- methylthiophen- 2- yl)methylidene]cycloheptanone
Smiles: Cc1ccc(s1)/C=C\1/CCCC/C(=C/c2ccc(s2)C)/C1=O

STK527337
Synonyms: 4- [(E)- {2- [2- (4- chlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]- 2- methoxyphenol
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2)Cl)ccc1O

STK527338
Synonyms: 6- [(E)- (2- {[(1,3- benzodioxol- 5- ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]- 2,3- dimethoxybenzoicacid(non- preferredname)
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCO2

STK527339
Synonyms: 3- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 5,6- diphenyl- 1,2,4- triazine
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nnc(c(n1)c1ccccc1)c1ccccc1

STK527341
Synonyms: 6- amino- 2- (propan- 2- yl)- 8- (thiophen- 2- yl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C(C)C)c1cccs1)(C#N)C#N

STK527344
Synonyms: 3,3'- [(3,5- dichloro- 2- methoxyphenyl)methanediyl]bis(2- methyl- 1H- indole)
Smiles: COc1c(Cl)cc(cc1C(c1c(C)[nH]c2c1cccc2)c1c(C)[nH]c2c1cccc2)Cl

STK527352
Synonyms: 4- (3,5- dimethylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (pyridin- 3- ylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: Cc1cc(C)c[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1cccnc1

STK527353
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- octyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527354
Synonyms: (3,4,5,6- tetrabromobenzene- 1,2- diyl)dimethanol
Smiles: OCc1c(CO)c(Br)c(c(c1Br)Br)Br

STK527355
Synonyms: diethyl(2,2- bis{[(6- chloro- 2- oxo- 1,3- benzoxazol- 3(2H)- yl)methyl]sulfanyl}- 1- cyanoethenyl)phosphonate
Smiles: CCOP(=O)(/C(=C(/SCn1c(=O)oc2c1ccc(c2)Cl)\SCn1c(=O)oc2c1ccc(c2)Cl)/C#N)OCC

STK527356
Synonyms: 5- [(E)- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}methyl]- 2- oxo- 4- [4- (pyridin- 4- yl)pyridinium- 1- yl]- 1,3- thiazol- 3- ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1O)[n+]1ccc(cc1)c1ccncc1

STK527357
Synonyms: N- (furan- 2- ylmethyl)- N'- (4- phenyl- 1,3- thiazol- 2- yl)ethanediamide
Smiles: O=C(C(=O)Nc1scc(n1)c1ccccc1)NCc1ccco1

STK527358
Synonyms: N- cycloheptyl- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: O=C(C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3)NC1CCCCCC1

STK527359
Synonyms: 3- methyl- 5- (phenylsulfanyl)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1c(Sc1ccccc1)cc(c3no2)C

STK527360
Synonyms: 3- methyl- 8- (morpholin- 4- yl)- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1

STK527361
Synonyms: 8- (benzylsulfanyl)- 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)O

STK527362
Synonyms: N- (1- acetyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)acetamide
Smiles: CC(=O)Nc1c(C)nn(c1C)C(=O)C

STK527363
Synonyms: (2E)- 2- (4- methoxybenzylidene)- 5,6- diphenylimidazo[2,1- b][1,3]thiazol- 3(2H)- one
Smiles: COc1ccc(cc1)/C=c\1/sc2n(c1=O)c(c(n2)c1ccccc1)c1ccccc1

STK527364
Synonyms: N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 1- nitro- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxamide
Smiles: O=C(c1ccc2c(c1[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)NCCC1=CCCCC1

STK527365
Synonyms: methyl4- {[2- (3,4- dichlorophenyl)quinazolin- 4- yl]oxy}benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527366
Synonyms: 4,4'- {[4- (dimethylamino)phenyl]methanediyl}bis(1- hexyl- 3- methyl- 1H- pyrazol- 5- ol)
Smiles: CCCCCCn1nc(c(c1O)C(c1c(C)nn(c1O)CCCCCC)c1ccc(cc1)N(C)C)C

STK527367
Synonyms: 4- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 2- (2- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK527370
Synonyms: 5- [(E)- {2- [3- (9H- carbazol- 9- yl)propanoyl]hydrazinylidene}methyl]- 4- (3- methylpyridinium- 1- yl)- 2- oxo- 1,3- thiazol- 3- ide
Smiles: O=C(CCn1c2ccccc2c2c1cccc2)N/N=C/c1sc(=O)[n-]c1[n+]1cccc(c1)C

STK527371
Synonyms: 8- bromo- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK527372
Synonyms: methyl3,3,3- trifluoro- 2- (5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- (2- phenylhydrazinyl)propanoate
Smiles: COC(=O)C(C(F)(F)F)(c1c(C)[nH]n(c1=O)c1ccccc1)NNc1ccccc1

STK527373
Synonyms: 1- ethyl- 6- fluoro- N,N- bis(3- methylbutyl)- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)N(CCC(C)C)CCC(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527374
Synonyms: ethyl[(3- methyl- 7- nonyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetate
Smiles: CCCCCCCCCn1c(SCC(=O)OCC)nc2c1c(=O)[nH]c(=O)n2C

STK527377
Synonyms: 2- benzyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexane]- 4(6H)- thione
Smiles: S=c1[nH]c(Cc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1

STK527378
Synonyms: 1- dodecyl- 1H- indole- 2,3- dione
Smiles: CCCCCCCCCCCCN1c2ccccc2C(=O)C1=O

STK527379
Synonyms: 4- (2- amino- 3,5- dicyano- 6- {[2- oxo- 2- (2- oxo- 2H- chromen- 3- yl)ethyl]sulfanyl}pyridin- 4- yl)phenylacetate
Smiles: N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc(c(c1c1ccc(cc1)OC(=O)C)C#N)N

STK527380
Synonyms: methyl3- ({[4- (7- ethyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)cc(cc2)C

STK527381
Synonyms: N'- [(1E)- 1- (6,8- dichloro- 2- oxo- 2H- chromen- 3- yl)ethylidene]benzohydrazide
Smiles: Clc1cc(Cl)c2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccccc1)/C

STK527382
Synonyms: [3- amino- 4- (2- methoxyphenyl)- 6- phenylthieno[2,3- b]pyridin- 2- yl](4- methylphenyl)methanone
Smiles: COc1ccccc1c1cc(nc2c1c(N)c(s2)C(=O)c1ccc(cc1)C)c1ccccc1

STK527383
Synonyms: 8- {(2E)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(N/N=C(/c2ccc(cc2)OC)\C)nc2c1c(=O)[nH]c(=O)n2C

STK527385
Synonyms: 2- (4- chlorophenyl)- N- (4- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527386
Synonyms: 8- bromo- 3- ({(E)- [3- (hydroxymethyl)- 4- methoxyphenyl]methylidene}amino)- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: OCc1cc(ccc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527387
Synonyms: 2- [bis(5- methylfuran- 2- yl)methyl]- 4,6- diiodophenol
Smiles: Cc1ccc(o1)C(c1cc(I)cc(c1O)I)c1ccc(o1)C

STK527388
Synonyms: 8,13- dioxo- 13,14- dihydro- 8H- naphtho[2,3- a]phenoxazin- 7- ylacetate
Smiles: CC(=O)Oc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK527391
Synonyms: 5- [2- ethoxy- 5- (morpholin- 4- ylsulfonyl)phenyl]- 1- methyl- 3- propyl- 1,6- dihydro- 7H- pyrazolo[4,3- d]pyrimidin- 7- one
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCOCC1)C

STK527394
Synonyms: 2- (3- benzyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)- 1- (3,4- dichlorophenyl)ethanol
Smiles: OC(c1ccc(c(c1)Cl)Cl)Cn1c(=N)n(c2c1cccc2)Cc1ccccc1

STK527396
Synonyms: N- (4- methoxybenzyl)- N- phenyl- 10H- phenothiazine- 10- carboxamide
Smiles: COc1ccc(cc1)CN(C(=O)N1c2ccccc2Sc2c1cccc2)c1ccccc1

STK527397
Synonyms: (2E)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(2- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1F)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK527399
Synonyms: methyl5- chloro- 3- [({1- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 3,4- dihydroisoquinolin- 2(1H)- yl}acetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)Cl

STK527400
Synonyms: ethyl5- fluoro- 3- ({[4- (4- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)F

STK527401
Synonyms: (2E)- 3- [(4- iodophenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)I)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527402
Synonyms: 2- (3,4- dichlorophenyl)- N- (3,5- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1cc(cc(c1)Cl)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527403
Synonyms: 1- ethyl- 6- fluoro- N- (2- hydroxyethyl)- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: OCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK527406
Synonyms: methyl3- {[(4- benzylpiperidin- 1- yl)acetyl]amino}- 5- chloro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cc(cc2)Cl

STK527407
Synonyms: methyl2- [2- (3,4- dimethoxyphenyl)ethyl]- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinoline- 6- carboxylate
Smiles: COc1cc(ccc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3C(=O)OC

STK527408
Synonyms: 1,1'- (disulfanediyldiethane- 2,1- diyl)bis{3- [3- (trifluoromethyl)phenyl]urea}
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)NCCSSCCNC(=O)Nc1cccc(c1)C(F)(F)F

STK527410
Synonyms: (5Z)- 3- (1,1- dioxidotetrahydrothiophen- 3- yl)- 5- [(5- hydroxy- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2c(C)nn(c2O)c2ccccc2)/C(=O)N1C1CCS(=O)(=O)C1

STK527411
Synonyms: 1,2,3,5- tetrabromo- 4- (bromomethyl)- 6- methoxybenzene
Smiles: COc1c(Br)c(CBr)c(c(c1Br)Br)Br

STK527414
Synonyms: 3- methyl- 7- (2- methylpropyl)- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1)C

STK527415
Synonyms: ethyl1- [2- (1H- indol- 3- yl)- 2- oxoethyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK527416
Synonyms: 8- bromo- 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Oc1ccc(c(c1)O)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)Br

STK527419
Synonyms: 2- ({(E)- [1- (4- nitrophenyl)- 1H- pyrrol- 2- yl]methylidene}amino)- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])sc2c1CCCCC2

STK527420
Synonyms: 3- benzyl- 2- (prop- 2- en- 1- ylsulfanyl)- 2,3- dihydro- 1H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C=CCSC1NC2=C(C(=O)N1Cc1ccccc1)C1(Cc3c2cccc3)CCCC1

STK527421
Synonyms: 4- {[(E)- (3- ethenyl- 2- hydroxyphenyl)methylidene]amino}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: C=Cc1cccc(c1O)/C=N/c1c(C)n(n(c1=O)c1ccccc1)C

STK527422
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 3- [2- (pyridin- 3- yl)piperidin- 1- yl]propanehydrazide
Smiles: O=C(CCN1CCCCC1c1cccnc1)N/N=C/c1ccc2c(c1)OCO2

STK527423
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 8- {(2Z)- 2- [(3E)- 4- phenylbut- 3- en- 2- ylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C(=N/Nc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C)/C=C/c1ccccc1

STK527424
Synonyms: 7- ethyl- 8- {4- [2- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)- 2- oxoethyl]piperazin- 1- yl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)c(n2C)C

STK527426
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

STK527427
Synonyms: butyl4- {[(4- chlorophenyl)(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)methyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)Cl

STK527430
Synonyms: 2- [(E)- ({4- [bis(5- methylfuran- 2- yl)methyl]phenyl}imino)methyl]- 4- nitrophenol
Smiles: Cc1ccc(o1)C(c1ccc(o1)C)c1ccc(cc1)/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK527432
Synonyms: 2- [2- (1,3- diphenyl- 1H- pyrazol- 4- yl)hydrazinyl]- 3- phenylquinazolin- 4(3H)- one
Smiles: O=c1c2ccccc2nc(n1c1ccccc1)NNc1cn(nc1c1ccccc1)c1ccccc1

STK527434
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- bromophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527436
Synonyms: 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 1,3- diphenyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: S=C1N(c2ccccc2)C(=O)/C(=C/C=C/c2ccco2)/C(=O)N1c1ccccc1

STK527437
Synonyms: N- (3,4- difluorophenyl)- 4- hydroxy- 1- (3- methylbutyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CC(CCn1c(=O)c(C(=O)Nc2ccc(c(c2)F)F)c(c2c1cccc2)O)C

STK527438
Synonyms: (4- bromophenyl)(2,2,2',2',4,4'- hexamethyl- 1,2,3,4- tetrahydro- 4,6'- biquinolin- 1'(2'H)- yl)methanone
Smiles: Brc1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2

STK527442
Synonyms: 2- (2,6- dimethoxyphenoxy)- N- (tetrahydrofuran- 2- ylmethyl)ethanamine
Smiles: COc1cccc(c1OCCNCC1CCCO1)OC

STK527444
Synonyms: methyl3- {[3- (3,4- dihydroisoquinolin- 2(1H)- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCc3c(C1)cccc3)cccc2

STK527445
Synonyms: 4- (4- tert- butylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: O=C(c1ccccc1)N/N=C/c1sc(=O)[n-]c1[n+]1ccc(cc1)C(C)(C)C

STK527446
Synonyms: 8- hydrazinyl- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(NN)nc2c1c(=O)[nH]c(=O)n2C

STK527447
Synonyms: (2E)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]- 3- {[4- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C(C)C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK527448
Synonyms: 2- (4- chlorophenyl)- N- (3,4- difluorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2ccc(c(c2)F)F)c2c(n1)cccc2

STK527450
Synonyms: ethyl3,3,3- trifluoro- N- [(5- methyl- 4,5- dihydro- 1,3- thiazol- 2- yl)(6- methylpyridin- 2- yl)carbamoyl]- 2- (2,2,2- trifluoroethoxy)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)N(c1cccc(n1)C)C1=NCC(S1)C)OCC(F)(F)F

STK527451
Synonyms: (5Z)- 3- benzyl- 5- (3- nitrobenzylidene)- 2- phenyl- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C1/C(=C/c2cccc(c2)[N+](=O)[O-])/N=C(N1Cc1ccccc1)c1ccccc1

STK527452
Synonyms: 4- ethoxy- N,N- bis(2- hydroxyethyl)- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N(CCO)CCO)C

STK527454
Synonyms: 8- chloro- 3- (pyridin- 3- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1cccnc1

STK527455
Synonyms: 3- [4- (3- methylbutoxy)phenyl]- 1,5- di(naphthalen- 2- yl)pentane- 1,5- dione
Smiles: CC(CCOc1ccc(cc1)C(CC(=O)c1ccc2c(c1)cccc2)CC(=O)c1ccc2c(c1)cccc2)C

STK527457
Synonyms: ethyl2- (3- {[(3,4- dichlorophenyl)carbamoyl]amino}- 4- methylphenyl)- 3,3,3- trifluoro- 2- hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(c(c1)NC(=O)Nc1ccc(c(c1)Cl)Cl)C)O

STK527459
Synonyms: N,N- dimethyl- N'- (4- nitro- 2,1,3- benzoxadiazol- 5- yl)propane- 1,3- diamine
Smiles: CN(CCCNc1ccc2c(c1[N+](=O)[O-])non2)C

STK527460
Synonyms: 4- (2,6- dimethoxyphenoxy)- N- (furan- 2- ylmethyl)butan- 1- amine
Smiles: COc1cccc(c1OCCCCNCc1ccco1)OC

STK527461
Synonyms: 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527462
Synonyms: 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCOc1ccc(cc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527463
Synonyms: N- {4- tert- butyl- 1- [1- (2- methylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- 4- chloro- N- nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1ccccc1C)c1ccc(cc1)Cl

STK527464
Synonyms: 8- {(2E)- 2- [1- (4- bromophenyl)ethylidene]hydrazinyl}- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(N/N=C(/c2ccc(cc2)Br)\C)nc2c1c(=O)[nH]c(=O)n2C)C

STK527465
Synonyms: ethylN- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)- 3,3,3- trifluoro- 2- {[(2- fluorophenyl)carbonyl]amino}alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCCC2)NC(=O)c1ccccc1F

STK527467
Synonyms: 8- bromo- 3- {[(E)- pyridin- 4- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccncc1

STK527468
Synonyms: 3- (pyridin- 3- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1cccnc1

STK527469
Synonyms: ethyl3- [(E)- 3,4- dihydroisoquinolin- 2(1H)- yldiazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCc3c(C1)cccc3)cccc2

STK527470
Synonyms: methyl3- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK527472
Synonyms: N- acetyl- N- (3'- cyano- 1'H- spiro[cyclohexane- 1,2'- naphthalen]- 4'- yl)acetamide
Smiles: N#CC1=C(N(C(=O)C)C(=O)C)c2ccccc2CC21CCCCC2

STK527473
Synonyms: methyl5- bromo- 3- ({[4- (2- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cc(cc2)Br

STK527474
Synonyms: (2E)- 6,7- dimethyl- 2- [(2E)- 3- (5- nitrofuran- 2- yl)prop- 2- en- 1- ylidene][1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: [O-][N+](=O)c1ccc(o1)/C=C/C=c\1/sc2n(c1=O)c1c(n2)cc(c(c1)C)C

STK527475
Synonyms: 3- methyl- 7- nonyl- 8- (propylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527476
Synonyms: 3- {[(E)- (3- iodophenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)I

STK527478
Synonyms: 8- (butan- 2- ylsulfanyl)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SC(CC)C)nc2c1c(=O)[nH]c(=O)n2C

STK527480
Synonyms: 4- [(3- methyl- 2,4,6- trinitrophenyl)amino]benzoicacid
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1Nc1ccc(cc1)C(=O)O)[N+](=O)[O-])C

STK527482
Synonyms: 8- [(2E)- but- 2- en- 1- ylsulfanyl]- 3- methyl- 7- (3- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/CSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C

STK527483
Synonyms: (2Z)- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- ethoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccccc1N/C=C(\c1scc(n1)c1ccc(c(c1)C)C)/C#N

STK527484
Synonyms: N- (propan- 2- yl)- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CC(NC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3)C

STK527485
Synonyms: (2E)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(cc1)C

STK527486
Synonyms: 3,3,5,5- tetramethyl- 6- (trichloromethyl)dihydro- 2H- pyran- 2,4(3H)- dione
Smiles: O=C1OC(C(Cl)(Cl)Cl)C(C(=O)C1(C)C)(C)C

STK527488
Synonyms: 7- (2,4- dichlorophenyl)- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: Clc1ccc(c(c1)Cl)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK527490
Synonyms: N,N- diethyl- 3- [2- (4- methoxyphenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]propan- 1- amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)OC)CC

STK527491
Synonyms: N'- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1- yl)pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)NNC1=NC(C)(C)Cc2c1cccc2

STK527492
Synonyms: 8- methoxy- 3- {[(E)- (2,4,6- trimethoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cc(OC)c(c(c1)OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK527493
Synonyms: N- {(2E)- 3- (3- nitrophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

STK527494
Synonyms: 8- (diethylamino)- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(CC)CC

STK527496
Synonyms: 8- methoxy- 3- [2- (morpholin- 4- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCOCC1

STK527498
Synonyms: 1- (diphenylmethyl)- 4- {2- [2- (naphthalen- 1- yloxy)ethoxy]ethyl}piperazine
Smiles: O(CCN1CCN(CC1)C(c1ccccc1)c1ccccc1)CCOc1cccc2c1cccc2

STK527501
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(2- chlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc2c(c1)OCO2

STK527505
Synonyms: 1- methyl- 4- [4- (naphthalen- 1- yloxy)butyl]piperazine
Smiles: CN1CCN(CC1)CCCCOc1cccc2c1cccc2

STK527508
Synonyms: 2,2- bis(4- chlorophenyl)- N'- [(E)- (4- chlorophenyl)methylidene]- 2- hydroxyacetohydrazide
Smiles: Clc1ccc(cc1)/C=N/NC(=O)C(c1ccc(cc1)Cl)(c1ccc(cc1)Cl)O

STK527509
Synonyms: 2- (4- chlorophenyl)- N- (naphthalen- 1- yl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(n1)Nc1cccc2c1cccc2

STK527513
Synonyms: 3- methyl- 7- octyl- 8- (pentylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527514
Synonyms: 4,6- bis(4- methoxyphenyl)- 2- {[2- (4- methylphenyl)- 2- oxoethyl]sulfanyl}pyridine- 3- carbonitrile
Smiles: COc1ccc(cc1)c1nc(SCC(=O)c2ccc(cc2)C)c(c(c1)c1ccc(cc1)OC)C#N

STK527515
Synonyms: 7- (3- bromobenzyl)- 8- (hexylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527518
Synonyms: 3- imino- 1,7- dimethyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC1(C#N)C(C)C2(C)OCC1(C#N)C(=N)O2

STK527519
Synonyms: 3- {[(E)- (3- ethoxy- 4- hydroxyphenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCOc1cc(ccc1O)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK527521
Synonyms: N- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2scc(n2)c2ccc(cc2)Br)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527522
Synonyms: 3- ({(E)- [2- hydroxy- 3- (prop- 2- en- 1- yl)phenyl]methylidene}amino)- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527523
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 3- methyl- 8- (pentylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCSc1nc2c(n1CC(COc1ccc(cc1)Cl)O)c(=O)[nH]c(=O)n2C

STK527524
Synonyms: 8- methyl- 3- (pyridin- 4- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccncc1

STK527525
Synonyms: ethyl3- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OCC

STK527526
Synonyms: methyl3- ({[4- (4- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK527527
Synonyms: 8- chloro- 3- [2- (4- methoxyphenyl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK527528
Synonyms: 2- amino- 1- (2- chlorophenyl)- 4,4- bis(trifluoromethyl)- 4,5,6,7,8,9- hexahydro- 1H- cyclohepta[b]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2ccccc2Cl)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCCC2

STK527529
Synonyms: 1- ethyl- 6- fluoro- N- (3- fluorobenzyl)- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2cccc(c2)F)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527530
Synonyms: 3- amino- N,N- dibutyl- 4- (2- oxopyrrolidin- 1- yl)benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccc(c(c1)N)N1CCCC1=O)CCCC

STK527531
Synonyms: 2- (1,5- diphenyl- 4,5- dihydro- 1H- pyrazol- 3- yl)phenol
Smiles: Oc1ccccc1C1=NN(C(C1)c1ccccc1)c1ccccc1

STK527533
Synonyms: 2,2'- (1,3,4- thiadiazole- 2,5- diyldisulfanediyl)bis{N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]acetohydrazide}
Smiles: O=C(CSc1nnc(s1)SCC(=O)N/N=C/c1ccc2c(c1)OCO2)N/N=C/c1ccc2c(c1)OCO2

STK527534
Synonyms: 1- {(E)- [(5- methylpyridin- 2- yl)imino]methyl}- 6- nitronaphthalen- 2- ol
Smiles: Cc1ccc(nc1)/N=C/c1c(O)ccc2c1ccc(c2)[N+](=O)[O-]

STK527535
Synonyms: N- benzyl- 4- fluoro- N'- (propan- 2- ylidene)benzenesulfonohydrazide
Smiles: Fc1ccc(cc1)S(=O)(=O)N(N=C(C)C)Cc1ccccc1

STK527536
Synonyms: 3- {[(E)- (2- hydroxy- 5- methoxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(c(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC)O

STK527537
Synonyms: 2- (4- bromophenyl)- N- cyclohexylquinazolin- 4- amine
Smiles: Brc1ccc(cc1)c1nc(NC2CCCCC2)c2c(n1)cccc2

STK527538
Synonyms: N'- [3- methyl- 2,6- dioxo- 7- (2- phenylethyl)- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]formichydrazide
Smiles: O=CNNc1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C

STK527539
Synonyms: 2- {[(1Z)- 8- methoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]amino}- 4- methylphenol
Smiles: COc1ccc2c(c1)c1/c(=N/c3cc(C)ccc3O)/ssc1C(N2)(C)C

STK527540
Synonyms: ethyl4- {[(1E)- 3- (2,4- dimethoxyphenyl)- 3- oxoprop- 1- en- 1- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/C=C/C(=O)c1ccc(cc1OC)OC

STK527541
Synonyms: 6- [(2- amino- 2- oxoethyl)sulfanyl]- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)N)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1OC)C

STK527542
Synonyms: 7- {4- methoxy- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]phenyl}- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK527543
Synonyms: 2- oxo- 7- (phenylcarbonyl)pyrido[1,2- a][1,3]thiazolo[5,4- e]pyrimidin- 10- ium- 1- ide
Smiles: O=c1sc2c([n-]1)[n+]1ccc(cc1nc2)C(=O)c1ccccc1

STK527544
Synonyms: 6,7,8,9,10,10a- hexahydrocyclohepta[b]indeno[1,2- e]pyrazin- 12(5aH)- one5,11- dioxide
Smiles: [O-][N+]1=C2c3ccccc3C(=O)C2=[N+](C2C1CCCCC2)[O-]

STK527547
Synonyms: 3- {[(E)- (2- hydroxy- 5- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(c(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1)O

STK527548
Synonyms: N- (3,4- difluorophenyl)- 4- hydroxy- 1- (2- methylpropyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CC(Cn1c(=O)c(C(=O)Nc2ccc(c(c2)F)F)c(c2c1cccc2)O)C

STK527550
Synonyms: 2,7- bis(morpholin- 4- ylmethyl)- 1,8- bis(4- propoxyphenyl)octane- 1,8- dione
Smiles: CCCOc1ccc(cc1)C(=O)C(CN1CCOCC1)CCCCC(C(=O)c1ccc(cc1)OCCC)CN1CCOCC1

STK527552
Synonyms: ethyl4- (5- {(1Z)- 2- cyano- 3- [(2- ethoxyphenyl)amino]- 3- oxoprop- 1- en- 1- yl}furan- 2- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(\C(=O)Nc1ccccc1OCC)/C#N

STK527553
Synonyms: 8- methyl- 3- {[(E)- pyridin- 4- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccncc1

STK527554
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- (thiomorpholin- 4- yl)ethanone
Smiles: O=C(c1c(C)n(c2c1cccc2)C)CN1CCSCC1

STK527555
Synonyms: 8- bromo- 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527556
Synonyms: 2- [(E)- {2- [2- (2,4- dichlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]- 6- methoxyphenol
Smiles: COc1cccc(c1O)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK527558
Synonyms: 4,5- diphenyl- 2- (2,4,6- tribromophenyl)- 1H- imidazole
Smiles: Brc1cc(Br)c(c(c1)Br)c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK527559
Synonyms: 8- (hexylsulfanyl)- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK527560
Synonyms: (5Z)- 1- (4- ethoxyphenyl)- 5- [(octadecylamino)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCCCCCCCCCCCCCCCN/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCC

STK527561
Synonyms: 4- [2- amino- 3,5- dicyano- 6- (hexylsulfanyl)pyridin- 4- yl]phenylacetate
Smiles: CCCCCCSc1nc(N)c(c(c1C#N)c1ccc(cc1)OC(=O)C)C#N

STK527562
Synonyms: N'- [(3E)- 1- (azepan- 1- ylmethyl)- 5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- (1,3- benzothiazol- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(N/N=C/1\c2cc(Br)ccc2N(C1=O)CN1CCCCCC1)CSc1nc2c(s1)cccc2

STK527564
Synonyms: 4- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 1- ethylpiperidine
Smiles: CCN1CCC(CC1)c1scc(n1)c1cccc(c1)Br

STK527565
Synonyms: 4,5,6,7- tetrachloro- 2- [2- (dimethylamino)- 2- (1- methyl- 1H- indol- 3- yl)ethyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: CN(C(c1cn(c2c1cccc2)C)CN1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl)C

STK527566
Synonyms: 1- (3- nitro- 9H- carbazol- 9- yl)propan- 2- ol
Smiles: CC(Cn1c2ccc(cc2c2c1cccc2)[N+](=O)[O-])O

STK527569
Synonyms: 8- bromo- 3- [2- (diethylamino)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCN(CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)Br)CC

STK527571
Synonyms: 1- (2,2,2- trichloro- 1- hydroxyethyl)azepan- 2- one
Smiles: O=C1CCCCCN1C(C(Cl)(Cl)Cl)O

STK527573
Synonyms: N- [(3Z)- 2- methyl- 3- (phenylamino)- 3- (phenylimino)propyl]- N- phenylundecanamide
Smiles: CCCCCCCCCCC(=O)N(c1ccccc1)CC(/C(=N/c1ccccc1)/Nc1ccccc1)C

STK527574
Synonyms: 3- methyl- 8- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STK527576
Synonyms: 2- [(4- nitrophenyl)carbonyl]- N- [3- (trifluoromethyl)phenyl]hydrazinecarboxamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)NNC(=O)c1ccc(cc1)[N+](=O)[O-]

STK527577
Synonyms: ethyl4- {[(4- chlorophenyl)(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)methyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)Cl

STK527578
Synonyms: 1- methyl- 4- [6- (naphthalen- 1- yloxy)hexyl]piperazine
Smiles: CN1CCN(CC1)CCCCCCOc1cccc2c1cccc2

STK527579
Synonyms: ethyl(2Z)- 2- (1- acetyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 5- methyl- 3- oxo- 7- phenyl- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)n2c(=NC1c1ccccc1)s/c(=C\1/c3ccccc3N(C1=O)C(=O)C)/c2=O

STK527580
Synonyms: 7- hexadecyl- 3- methyl- 8- [(2- oxo- 2- phenylethyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK527582
Synonyms: 2- ethoxy- 4- (4- oxo- 1,2,3,4,5,6,7,8- octahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)phenylthiophene- 2- carboxylate
Smiles: CCOc1cc(ccc1OC(=O)c1cccs1)C1NC(=O)c2c(N1)sc1c2CCCC1

STK527584
Synonyms: 3,4- dichloro- N- [(1Z)- 4,4,8- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: Cc1ccc2c(c1)c1/c(=N/c3ccc(c(c3)Cl)Cl)/ssc1C(N2)(C)C

STK527585
Synonyms: dimethyl[(3- nitrophenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1cccc(c1)[N+](=O)[O-])Nc1ccccc1)OC

STK527587
Synonyms: furan- 2- yl{4- [4- (naphthalen- 1- yloxy)butyl]piperazin- 1- yl}methanone
Smiles: O=C(c1ccco1)N1CCN(CC1)CCCCOc1cccc2c1cccc2

STK527588
Synonyms: 8- bromo- 3- [2- (piperazin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCNCC1

STK527589
Synonyms: 1- ethyl- 6- fluoro- N- hexyl- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK527591
Synonyms: 3,3'- ({4- methoxy- 3- [(4- nitrophenoxy)methyl]phenyl}methanediyl)bis(4- hydroxy- 2H- chromen- 2- one)
Smiles: COc1ccc(cc1COc1ccc(cc1)[N+](=O)[O-])C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2

STK527592
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccc3c(c2)OCO3)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527593
Synonyms: (2E)- 2- ({[4- (2- methylpropoxy)phenyl]carbonyl}amino)- 3- phenylprop- 2- enoicacid
Smiles: CC(COc1ccc(cc1)C(=O)N/C(=C/c1ccccc1)/C(=O)O)C

STK527595
Synonyms: 2- (4- chlorophenyl)- 2- oxoethylN- {(2E)- 3- (4- methoxyphenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}glycinate
Smiles: COc1ccc(cc1)/C=C(\C(=O)NCC(=O)OCC(=O)c1ccc(cc1)Cl)/NC(=O)c1ccccc1

STK527596
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)O

STK527597
Synonyms: 2- (2- chlorophenyl)- 4- phenoxyquinazoline
Smiles: Clc1ccccc1c1nc(Oc2ccccc2)c2c(n1)cccc2

STK527598
Synonyms: 3- ({(E)- [4- (dimethylamino)phenyl]methylidene}amino)- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)N(C)C

STK527599
Synonyms: 8- bromo- 7- (3- chlorobenzyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1cccc(c1)Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK527600
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: c1ccc(cc1)CC1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK527601
Synonyms: methyl3- {[(4- ethylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK527603
Synonyms: 3- [(furan- 2- ylmethyl)amino]- 5- (phenylamino)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)NCc1ccco1

STK527605
Synonyms: 4- ethoxy- N- (2- methyl- 5- nitrophenyl)- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1cc(ccc1C)[N+](=O)[O-])C

STK527606
Synonyms: 8- [(1E)- 3- (2- fluorophenyl)triaz- 1- en- 1- yl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccccc1N/N=N/c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

STK527607
Synonyms: ethyl3- {[N- (2,2- dimethoxyethyl)- N- methylglycyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN(CC(OC)OC)C)cc(cc2)OC

STK527608
Synonyms: 2- [(E)- {2- [2- (4- chlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]- 6- methoxyphenol
Smiles: COc1cccc(c1O)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527609
Synonyms: ethyl5- methoxy- 3- ({[4- (4- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)OC)cc(cc2)OC

STK527612
Synonyms: 3- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1O

STK527613
Synonyms: 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527614
Synonyms: 3- (4- fluorophenyl)- 5- (4- methoxy- 6- methyl- 5,6,7,8- tetrahydro[1,3]dioxolo[4,5- g]isoquinolin- 6- ium- 5- yl)- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: COc1c2OCOc2cc2c1C([NH+](CC2)C)c1c(=O)[nH]c(=O)n(c1[O-])c1ccc(cc1)F

STK527615
Synonyms: 2- (4- bromophenyl)- 4- (4- methylpiperazin- 1- yl)quinazoline
Smiles: CN1CCN(CC1)c1nc(nc2c1cccc2)c1ccc(cc1)Br

STK527616
Synonyms: N- decyl- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK527617
Synonyms: N- [2- ({[(E)- amino(phenyl)methylidene]amino}oxy)- 1,1,1,3,3,3- hexafluoropropan- 2- yl]propanamide
Smiles: CCC(=O)NC(C(F)(F)F)(C(F)(F)F)O/N=C(\c1ccccc1)/N

STK527618
Synonyms: diethyl1- (9- ethyl- 9H- carbazol- 3- yl)- 2,5- dimethyl- 1H- pyrrole- 3,4- dicarboxylate
Smiles: CCOC(=O)c1c(C(=O)OCC)c(n(c1C)c1ccc2c(c1)c1ccccc1n2CC)C

STK527621
Synonyms: 3- methyl- 7- (3- phenylpropyl)- 8- (prop- 2- en- 1- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK527622
Synonyms: ethyl7- methoxy- 2- oxo- 2H- chromene- 3- carboxylate
Smiles: CCOC(=O)c1cc2ccc(cc2oc1=O)OC

STK527623
Synonyms: 7- hexadecyl- 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK527624
Synonyms: 2- [(2- bromo- 1- methylcyclopropyl)carbonyl]- N- (4- chlorophenyl)hydrazinecarboxamide
Smiles: O=C(Nc1ccc(cc1)Cl)NNC(=O)C1(C)CC1Br

STK527625
Synonyms: 2- (3,4- dichlorophenyl)- 4- (4- methylphenoxy)quinazoline
Smiles: Cc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527626
Synonyms: 7- (3- bromobenzyl)- 8- {(2E)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C)/C

STK527627
Synonyms: ethyl(2Z)- 5- methyl- 2- (1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 3- oxo- 7- phenyl- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)n2c(=NC1c1ccccc1)s/c(=C\1/c3ccccc3N(C1=O)C)/c2=O

STK527628
Synonyms: methyl5- bromo- 3- ({[4- (2- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cc(cc2)Br

STK527629
Synonyms: 2- methyl- 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK527630
Synonyms: N- (4- chlorobenzyl)- 7- {4- [(3- chlorophenyl)carbonyl]piperazin- 1- yl}- 1- cyclopropyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1cccc(c1)Cl)F

STK527631
Synonyms: 1- (4- ethoxyphenyl)- 2- phenylethane- 1,2- dione
Smiles: CCOc1ccc(cc1)C(=O)C(=O)c1ccccc1

STK527633
Synonyms: 3- methyl- 8- [(3- methylbutyl)sulfanyl]- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK527635
Synonyms: 2- [4- (1,3- benzodioxol- 5- yl)- 6- phenylpyridin- 2- yl]- 4- chlorophenol
Smiles: Clc1ccc(c(c1)c1cc(cc(n1)c1ccccc1)c1ccc2c(c1)OCO2)O

STK527636
Synonyms: N- [(1Z)- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]- 2- ethylaniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1ccccc1NC2(C)C

STK527637
Synonyms: 3- {[(E)- 1H- indol- 3- ylmethylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1nc2c3ccccc3[nH]c2c(=O)n1/N=C/c1c[nH]c2c1cccc2

STK527638
Synonyms: N- {2- [2- (4- bromophenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]ethyl}- 2- methylpropan- 2- amine
Smiles: Brc1ccc(cc1)c1cn2c(n1CCNC(C)(C)C)nc1c2cccc1

STK527642
Synonyms: (7Z,8Z,9E)- N,N',N''- trihydroxy- 1,4- dioxaspiro[4.5]decane- 7,8,9- triimine
Smiles: O/N=C/1\CC2(OCCO2)C/C(=N/O)/C1=N/O

STK527643
Synonyms: (2Z)- {(2E)- 3- methyl- 4- oxo- 2- [2- (phenylcarbonyl)hydrazinylidene]- 1,3- thiazolidin- 5- ylidene}ethanoicacid
Smiles: OC(=O)/C=C/1\S/C(=N/NC(=O)c2ccccc2)/N(C1=O)C

STK527644
Synonyms: N- {4- tert- butyl- 1- [1- (2- methylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- 2- methyl- N- nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1ccccc1C)c1ccccc1C

STK527645
Synonyms: 5- [(E)- {2- [3- (9H- carbazol- 9- yl)propanoyl]hydrazinylidene}methyl]- 4- (3- ethylpyridinium- 1- yl)- 2- oxo- 1,3- thiazol- 3- ide
Smiles: CCc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)CCn1c2ccccc2c2c1cccc2

STK527647
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2,5- dimethoxy- 4- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527652
Synonyms: 3- ({(E)- [4- (dimethylamino)- 2,3,5,6- tetrafluorophenyl]methylidene}amino)- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1c(/C=N/n2c(C)nc3c(c2=O)[nH]c2c3cccc2)c(F)c(c(c1F)N(C)C)F

STK527653
Synonyms: 2- (2,4- dichlorophenyl)- N- (2,5- dimethylphenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2cc(C)ccc2C)c2c(n1)cccc2

STK527654
Synonyms: (5Z)- 5- (4- methoxybenzylidene)- 1- methylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)/C=C\1/C(=O)NC(=O)N(C1=O)C

STK527656
Synonyms: ethylN- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)- 3,3,3- trifluoro- 2- (propanoylamino)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCCC2)NC(=O)CC

STK527657
Synonyms: 1- (diphenylmethyl)- 4- [4- (4- fluorophenoxy)butyl]piperazine
Smiles: Fc1ccc(cc1)OCCCCN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK527658
Synonyms: 4- {(2Z)- 2- [1- (4- iodophenyl)ethylidene]hydrazinyl}- 2- (4- methoxyphenyl)quinazoline
Smiles: COc1ccc(cc1)c1nc(N/N=C(\c2ccc(cc2)I)/C)c2c(n1)cccc2

STK527659
Synonyms: 3- methyl- 8- (nonylsulfanyl)- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK527660
Synonyms: N- {4- [(2- methoxy- 5- {(E)- [2- (pyridin- 4- ylcarbonyl)hydrazinylidene]methyl}benzyl)oxy]phenyl}acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=N/NC(=O)c1ccncc1

STK527662
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- (3- hydroxypyridin- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2ncccc2O)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527663
Synonyms: N,N'- (disulfanediyldiethane- 2,1- diyl)bis(4- fluorobenzenesulfonamide)
Smiles: Fc1ccc(cc1)S(=O)(=O)NCCSSCCNS(=O)(=O)c1ccc(cc1)F

STK527664
Synonyms: 1- (1H- indol- 3- yl)- 2- [4- (4- nitrophenyl)piperazin- 1- yl]ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK527665
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(4- chlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Cl)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527666
Synonyms: N- [4- ({[4- ethoxy- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)phenyl]sulfonyl}amino)phenyl]acetamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1ccc(cc1)NC(=O)C)C

STK527667
Synonyms: 6- (naphthalen- 1- yloxy)- N- (tetrahydrofuran- 2- ylmethyl)hexan- 1- amine
Smiles: C(CNCC1CCCO1)CCCCOc1cccc2c1cccc2

STK527669
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 1- ethyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCn1c(=O)c(C(=O)NCc2ccc3c(c2)OCO3)c(c2c1cccc2)O

STK527670
Synonyms: 1- (2,6- dichlorobenzyl)pyridin- 4(1H)- imine
Smiles: Clc1cccc(c1Cn1ccc(=N)cc1)Cl

STK527671
Synonyms: N'- [(Z)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2,3- dihydronaphtho[2,3- b][1,4]dioxine- 2- carbohydrazide
Smiles: O=C(C1COc2c(O1)cc1c(c2)cccc1)N/N=C\c1cccn1C

STK527673
Synonyms: 1- (1- methyl- 4- nitro- 1H- imidazol- 5- yl)piperidine
Smiles: Cn1cnc(c1N1CCCCC1)[N+](=O)[O-]

STK527674
Synonyms: methyl2- {[(4- chlorophenyl)carbonyl]amino}- N- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)- 3,3,3- trifluoroalaninate
Smiles: N#Cc1c(sc2c1CCCCC2)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1)Cl

STK527676
Synonyms: (Z)- 1- (2- chlorophenyl)- 2- [1- (2- phenoxyethyl)- 1H- benzimidazol- 2- yl]ethenyl2- chlorobenzoate
Smiles: Clc1ccccc1/C(=C/c1nc2c(n1CCOc1ccccc1)cccc2)/OC(=O)c1ccccc1Cl

STK527678
Synonyms: propyl4- {[{[2- (diethylamino)ethyl]amino}(oxo)acetyl]amino}benzoate
Smiles: CCCOC(=O)c1ccc(cc1)NC(=O)C(=O)NCCN(CC)CC

STK527679
Synonyms: 3- {[(E)- anthracen- 9- ylmethylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1c2ccccc2cc2c1cccc2

STK527680
Synonyms: methyl3- {[(4- ethylpiperazin- 1- yl)acetyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: CCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK527681
Synonyms: 7- hexyl- 8- {(2E)- 2- [1- (4- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(=O)[nH]c(=O)n2C

STK527682
Synonyms: N- tert- butyl- 1- methyl- 4- nitro- 1H- imidazol- 5- amine
Smiles: CC(Nc1n(C)cnc1[N+](=O)[O-])(C)C

STK527685
Synonyms: 3- methyl- 8- (4- methylpiperazin- 1- yl)- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(=C)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C

STK527686
Synonyms: ethyl{10- [N- (3- methyltricyclo[3.3.1.1~3,7~]dec- 1- yl)- beta- alanyl]- 10H- phenothiazin- 2- yl}carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)N(C(=O)CCNC13CC4CC(C1)CC(C3)(C4)C)c1c(S2)cccc1

STK527687
Synonyms: N- (2- chlorophenyl)- 1,3- thiazol- 2- amine
Smiles: Clc1ccccc1Nc1nccs1

STK527690
Synonyms: 7- heptyl- 3- methyl- 8- {(2E)- 2- [(3E)- 4- phenylbut- 3- en- 2- ylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(N/N=C(/C=C/c2ccccc2)\C)nc2c1c(=O)[nH]c(=O)n2C

STK527691
Synonyms: 8- methoxy- 3- {[(E)- quinolin- 2- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc2c(n1)cccc2

STK527693
Synonyms: N- [4- (2- acetyl- 3- oxobut- 1- en- 1- yl)phenyl]propanamide
Smiles: CCC(=O)Nc1ccc(cc1)C=C(C(=O)C)C(=O)C

STK527694
Synonyms: 2- [(7- hexadecyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK527695
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 8- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C

STK527696
Synonyms: 2- amino- 1- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)- 4,4- bis(trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- cyclopenta[b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C2=C(CCC2)C(C(=C1N)C#N)(C(F)(F)F)C(F)(F)F

STK527697
Synonyms: 1- methyl- 7- [(2- phenylethyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3c(C)cccc3oc1cc2NCCc1ccccc1

STK527699
Synonyms: 2- (3- benzyl- 6- oxo- 1,4,5,6- tetrahydro- 1,2,4- triazin- 5- yl)- N'- [(1E)- 3- methylcyclohexylidene]acetohydrazide(non- preferredname)
Smiles: CC1CCC/C(=N\NC(=O)CC2NC(=NNC2=O)Cc2ccccc2)/C1

STK527700
Synonyms: 8- chloro- 3- [2- (diethylamino)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCN(CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl)CC

STK527703
Synonyms: 5- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 6- hydroxy- 3- phenyl- 2- (propylsulfanyl)pyrimidin- 4(3H)- one
Smiles: CCCSc1nc(O)c(c(=O)n1c1ccccc1)C1OC(=O)c2c1ccc(c2OC)OC

STK527704
Synonyms: 7- hexadecyl- 3- methyl- 8- (nonylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527705
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 3- (morpholin- 4- ylcarbonyl)quinolin- 4(1H)- one
Smiles: CCn1cc(C(=O)N2CCOCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527709
Synonyms: 3- (pyrrolidin- 1- yl)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1ccc(c3no2)N1CCCC1

STK527711
Synonyms: methyl2,4- dimethyl- 5- [(2E)- 3- (4- phenoxyphenyl)prop- 2- enoyl]- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1C)C(=O)/C=C/c1ccc(cc1)Oc1ccccc1

STK527713
Synonyms: (2Z)- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- ethoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccccc1N/C=C(\c1scc(n1)c1ccc(cc1C)C)/C#N

STK527714
Synonyms: 7- (3- bromobenzyl)- 8- [(4- chlorobutyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: ClCCCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527715
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- {[4- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C(C)C)/c1scc(n1)c1ccc2c(c1)OCO2

STK527716
Synonyms: 4- [bis(5- methylfuran- 2- yl)methyl]- N- {(E)- [5- (3- nitrophenyl)furan- 2- yl]methylidene}aniline
Smiles: Cc1ccc(o1)C(c1ccc(o1)C)c1ccc(cc1)/N=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

STK527717
Synonyms: N- [(1E)- 3- (benzylamino)- 1- (4- bromophenyl)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: Brc1ccc(cc1)/C=C(\C(=O)NCc1ccccc1)/NC(=O)c1ccccc1

STK527718
Synonyms: (2Z)- [(2E)- 2- [2- (tert- butoxycarbonyl)hydrazinylidene]- 4- oxo- 3- (prop- 2- en- 1- yl)- 1,3- thiazolidin- 5- ylidene]ethanoicacid
Smiles: C=CCN1/C(=N\NC(=O)OC(C)(C)C)/S/C(=C\C(=O)O)/C1=O

STK527719
Synonyms: 3- benzyl- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccccc1

STK527720
Synonyms: 7- ({(2Z)- 2- [5,7- dichloro- 3- (piperidin- 1- yl)- 1- benzofuran- 2(3H)- ylidene]ethyl}oxy)- 4- methyl- 2H- chromen- 2- one
Smiles: Clc1cc2C(N3CCCCC3)/C(=C/COc3ccc4c(c3)oc(=O)cc4C)/Oc2c(c1)Cl

STK527723
Synonyms: 3- methyl- 8- (methylamino)- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(NC)nc2c1c(=O)[nH]c(=O)n2C

STK527724
Synonyms: N,N- diethyl- 2- [2- (4- methoxyphenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]ethanamine
Smiles: CCN(CCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)OC)CC

STK527727
Synonyms: ethyl3- ({[4- (2,3- dimethylphenyl)piperazin- 1- yl]acetyl}amino)- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cc(cc2)F

STK527730
Synonyms: 3- [(3,4- difluorophenyl)amino]- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1ccc(c(c1)F)F

STK527731
Synonyms: 2- phenyl- N'- [(1Z)- 3,5,5- trimethylcyclohex- 2- en- 1- ylidene]quinoline- 4- carbohydrazide
Smiles: CC1=C/C(=N\NC(=O)c2cc(nc3c2cccc3)c2ccccc2)/CC(C1)(C)C

STK527732
Synonyms: methyl3- ({[4- (7- ethyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)cccc2

STK527733
Synonyms: 8- methyl- 3- {[(E)- (4- methylphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527734
Synonyms: 2- {[3- cyano- 6- cyclopropyl- 4- (2- fluorophenyl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc(cc1c1ccccc1F)C1CC1

STK527735
Synonyms: 3- (4- chlorophenoxy)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C(F)(F)F

STK527737
Synonyms: 6- cyclopropyl- 4- (4- methoxyphenyl)- 2- (prop- 2- en- 1- ylsulfanyl)pyridine- 3- carbonitrile
Smiles: C=CCSc1nc(cc(c1C#N)c1ccc(cc1)OC)C1CC1

STK527738
Synonyms: 1- [2- (butylsulfanyl)- 1,3- benzothiazol- 6- yl]- 3- phenylurea
Smiles: CCCCSc1nc2c(s1)cc(cc2)NC(=O)Nc1ccccc1

STK527739
Synonyms: N- {4- tert- butyl- 1- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- N- nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1c(C)cccc1C)c1ccccc1

STK527740
Synonyms: (2Z)- 3- [(2,3- dimethylphenyl)amino]- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)C)/c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK527741
Synonyms: 8- chloro- 3- {[(E)- (4- hydroxy- 3,5- dimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(/C=N/n2cnc3c(c2=O)[nH]c2c3cc(cc2)Cl)cc(c1O)OC

STK527742
Synonyms: 6- tert- butyl- 4- (furan- 2- yl)- 2- sulfanylpyridine- 3- carbonitrile
Smiles: N#Cc1c(S)nc(cc1c1ccco1)C(C)(C)C

STK527743
Synonyms: methyl5- bromo- 3- {[(4- phenylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cc(cc2)Br

STK527744
Synonyms: 1- hexadecyl- 1H- indole- 2,3- dione
Smiles: CCCCCCCCCCCCCCCCN1c2ccccc2C(=O)C1=O

STK527745
Synonyms: 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK527747
Synonyms: 2- (2,4- dichlorophenyl)- N- (4- methoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK527748
Synonyms: ethyl[(7- hexadecyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetate
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)OCC)nc2c1c(=O)[nH]c(=O)n2C

STK527749
Synonyms: 2- [(E)- {2- [2- (4- chlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]phenol
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2O)c2c(n1)cccc2

STK527750
Synonyms: diphenyl{[(4- bromophenyl)amino](phenyl)methyl}phosphonate
Smiles: Brc1ccc(cc1)NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1

STK527751
Synonyms: 7- (2- methoxyethyl)- 8- {(2E)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(N/N=C(/c2ccc(cc2)OC)\C)nc2c1c(=O)[nH]c(=O)n2C

STK527752
Synonyms: 8- (decylsulfanyl)- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK527753
Synonyms: (2E)- 3- {[2- chloro- 5- (trifluoromethyl)phenyl]amino}- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(ccc1Cl)C(F)(F)F)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527754
Synonyms: ethyl3- {[(4- benzylpiperidin- 1- yl)acetyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cc(cc2)F

STK527756
Synonyms: 4- (ethylsulfanyl)- 6- methyltetrahydropyrimidine- 2(1H)- thione
Smiles: CCSC1CC(C)NC(=S)N1

STK527757
Synonyms: 1- phenoxy- 3- [(2Z)- 2- (phenylimino)- 1,3- benzothiazol- 3(2H)- yl]propan- 2- ol
Smiles: OC(Cn1/c(=N/c2ccccc2)/sc2c1cccc2)COc1ccccc1

STK527758
Synonyms: 7- (3- bromobenzyl)- 8- (decylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527760
Synonyms: 1- methyl- 3- nonyl- 6,7- dihydro[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCCCCCn1c(=O)c2n3CCSc3nc2n(c1=O)C

STK527761
Synonyms: 8- [(2E)- 2- (3- bromo- 5- ethoxy- 4- hydroxybenzylidene)hydrazinyl]- 7- (2- hydroxyethyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCOc1cc(/C=N/Nc2nc3c(n2CCO)c(=O)n(c(=O)n3C)C)cc(c1O)Br

STK527763
Synonyms: 3- {[7- (3- bromobenzyl)- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}propanoicacid
Smiles: OC(=O)CCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527764
Synonyms: ethyl2- {[(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2cc(Br)cc(c2O)Br)sc2c1CCN(C2)C

STK527765
Synonyms: 7- heptyl- 8- {(2E)- 2- [1- (4- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(=O)[nH]c(=O)n2C

STK527766
Synonyms: 3- methyl- 8- {(2E)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc2c1c(=O)[nH]c(=O)n2C

STK527767
Synonyms: N- cycloheptyl- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NC2CCCCCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527769
Synonyms: 3- (3- chloro- 2- methylphenyl)- 5- phenyl- 3a,6a- dihydrospiro[furo[3,4- c]pyrrole- 1,2'- indene]- 1',3',4,6(3H,5H)- tetrone
Smiles: O=C1N(c2ccccc2)C(=O)C2C1C(OC12C(=O)c2c(C1=O)cccc2)c1cccc(c1C)Cl

STK527770
Synonyms: 8- [(2E)- but- 2- en- 1- ylsulfanyl]- 3- methyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/CSc1nc2c(n1C(C)C)c(=O)[nH]c(=O)n2C

STK527774
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccccc2Cl)ccc1OC

STK527776
Synonyms: 2- {[2- (biphenyl- 4- yl)- 2- oxoethyl]sulfanyl}- 4,6- bis(4- methoxyphenyl)pyridine- 3- carbonitrile
Smiles: COc1ccc(cc1)c1nc(SCC(=O)c2ccc(cc2)c2ccccc2)c(c(c1)c1ccc(cc1)OC)C#N

STK527777
Synonyms: ethyl5- fluoro- 3- ({[4- (3- methyl- 2,6- dioxo- 7- propyl- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OCC

STK527780
Synonyms: N- (2- hexyl- 4- oxoquinazolin- 3(4H)- yl)- 4- hydroxy- 2- oxo- 1- propyl- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)CCC

STK527781
Synonyms: 2- (3- methyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)- N'- [(1Z)- 1- (4- nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)[nH]c(=O)n2C)N/N=C(\c1ccc(cc1)[N+](=O)[O-])/C

STK527783
Synonyms: N- (2- methoxyphenyl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(C)cc(=O)oc1C

STK527785
Synonyms: methyl(2E)- 2- (2- chlorobenzylidene)- 5- (4- fluorophenyl)- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)c(=O)/c(=C\c1ccccc1Cl)/s2

STK527786
Synonyms: 8- bromo- 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527787
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- N- (2- phenylethyl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCCc2ccccc2)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527789
Synonyms: 2- (4- methoxyphenyl)- 6- (piperidin- 1- ylcarbonyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: COc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)ccc3C(=O)N1CCCCC1

STK527793
Synonyms: dimethyl{[(4- methoxyphenyl)amino](phenyl)methyl}phosphonate
Smiles: COP(=O)(C(c1ccccc1)Nc1ccc(cc1)OC)OC

STK527794
Synonyms: ethyl3- ({[4- (4- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)OC

STK527796
Synonyms: 8- (benzylamino)- 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK527798
Synonyms: (2Z)- 3- [(5- chloro- 2- hydroxyphenyl)amino]- 1- (naphthalen- 1- yl)prop- 2- en- 1- one
Smiles: Clc1ccc(c(c1)N/C=C\C(=O)c1cccc2c1cccc2)O

STK527799
Synonyms: 4- [2,4- bis(2- methylbutan- 2- yl)phenoxy]- N- {4- [5- oxo- 4- (2- phenyl- 2H- 1lambda~4~,2,3,4,5- thiatetrazol- 1- yl)- 3- (pyrrolidin- 1- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]phenyl}butanamide
Smiles: CCC(c1cc(ccc1OCCCC(=O)Nc1ccc(cc1)N1N=C(C(C1=O)S1=NN=NN1c1ccccc1)N1CCCC1)C(CC)(C)C)(C)C

STK527800
Synonyms: octamethyl9',9''- (phenylmethanediyl)bis(5',5',6'- trimethyl- 5',6'- dihydrospiro[1,3- dithiole- 2,1'- thiopyrano[2,3- c]quinoline]- 2',3',4,5- tetracarboxylate)
Smiles: COC(=O)C1=C(SC2(S1)C(=C(SC1=C2c2cc(ccc2N(C1(C)C)C)C(c1ccc2c(c1)C1=C(C(N2C)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)c1ccccc1)C(=O)OC)C(=O)OC)C(=O)OC

STK527802
Synonyms: ethyl4- {[2- (2- methylphenyl)quinazolin- 4- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccccc1C

STK527803
Synonyms: 4- (3,4- dimethylpyridinium- 1- yl)- 5- [(E)- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}methyl]- 2- oxo- 1,3- thiazol- 3- ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(c(c1)C)C)/C=N/NC(=O)c1ccccc1O

STK527804
Synonyms: 8- (dodecylsulfanyl)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCCCCCC)c(=O)[nH]c(=O)n2C

STK527805
Synonyms: (5E)- 1- (3- chlorophenyl)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C\C=C\c2ccco2)/C1=O

STK527807
Synonyms: 2- (2- chlorophenyl)- N- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1cc(ccc1Cl)Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK527808
Synonyms: 8- methoxy- 3- {[(E)- pyridin- 3- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccnc1

STK527810
Synonyms: N- (4- tert- butyl- 2- nitrophenyl)- 2- (phenylcarbonyl)benzamide
Smiles: O=C(c1ccccc1C(=O)Nc1ccc(cc1[N+](=O)[O-])C(C)(C)C)c1ccccc1

STK527813
Synonyms: 5- (4- bromophenyl)- 3- (3- chloro- 2- methylphenyl)- 3a,6a- dihydrospiro[furo[3,4- c]pyrrole- 1,2'- indene]- 1',3',4,6(3H,5H)- tetrone
Smiles: Brc1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2c2cccc(c2C)Cl)C(=O)c2c(C1=O)cccc2

STK527814
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- (5- methylpyridin- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2ccc(cn2)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527815
Synonyms: N- {2- [(3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 2- ethoxybenzamide
Smiles: CCOc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(c1C#N)CCCCC2

STK527816
Synonyms: 8- methyl- 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK527817
Synonyms: 3,3'- ({4- methoxy- 3- [(4- nitro- 1H- pyrazol- 1- yl)methyl]phenyl}methanediyl)bis(4- hydroxy- 2H- chromen- 2- one)
Smiles: COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2

STK527819
Synonyms: 7- (3- bromobenzyl)- 8- (dodecylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527820
Synonyms: 3- {[(E)- (4- methoxyphenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C

STK527821
Synonyms: 8- [(2E)- 2- benzylidenehydrazinyl]- 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(N/N=C/c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK527825
Synonyms: (7- amino- 2,2,4- trimethyl- 4- phenyl- 3,4- dihydroquinolin- 1(2H)- yl)(4- propylphenyl)methanone
Smiles: CCCc1ccc(cc1)C(=O)N1c2cc(N)ccc2C(CC1(C)C)(C)c1ccccc1

STK527827
Synonyms: 5- benzyl- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinoline- 1- thione
Smiles: S=c1ssc2c1c1ccccc1N(C2(C)C)Cc1ccccc1

STK527828
Synonyms: ethyl2- {[(E)- (2- hydroxy- 5- iodophenyl)methylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2cc(I)ccc2O)sc2c1CCN(C2)C

STK527830
Synonyms: 2- (4- methylphenyl)- 1- [2- (pyrrolidin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: Cc1ccc(cc1)c1cn2c(n1CCN1CCCC1)nc1c2cccc1

STK527832
Synonyms: ethyl5- methoxy- 3- {[(4- phenylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cc(cc2)OC

STK527833
Synonyms: 2,2',2''- methanetriyltris[5- (4- bromophenyl)furan]
Smiles: Brc1ccc(cc1)c1ccc(o1)C(c1ccc(o1)c1ccc(cc1)Br)c1ccc(o1)c1ccc(cc1)Br

STK527836
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Fc1ccccc1/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK527837
Synonyms: N,2- bis(4- chlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527839
Synonyms: 1- [2- (4- fluorophenoxy)ethyl]- 4- (2- methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCOc1ccc(cc1)F

STK527840
Synonyms: ethyl4- {(2Z)- 3- (2- methoxyphenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)/C(=C/c1ccccc1OC)/NC(=O)c1ccccc1

STK527842
Synonyms: tert- butyl2- {[(E)- (2- hydroxy- 3,5- diiodophenyl)methylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxylate
Smiles: CN1CCc2c(C1)sc(c2C(=O)OC(C)(C)C)/N=C/c1cc(I)cc(c1O)I

STK527846
Synonyms: 4- [(4- oxo- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- yl)methyl]benzonitrile
Smiles: N#Cc1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cccc1

STK527847
Synonyms: (4- ethylphenyl)(2,2,2',2',4,4'- hexamethyl- 1,2,3,4- tetrahydro- 4,6'- biquinolin- 1'(2'H)- yl)methanone
Smiles: CCc1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2

STK527848
Synonyms: 2- [(3- methyl- 7- octyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]- N- phenylacetamide
Smiles: CCCCCCCCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK527849
Synonyms: 2- chloro- N- [(1E)- 1- (4- fluorophenyl)- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: Fc1ccc(cc1)/C=C(\C(=O)NCCc1c[nH]c2c1cccc2)/NC(=O)c1ccccc1Cl

STK527850
Synonyms: diphenyl{[(4- nitrophenyl)amino](phenyl)methyl}phosphonate
Smiles: [O-][N+](=O)c1ccc(cc1)NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1

STK527855
Synonyms: 1- (2- methoxyphenyl)- 4- [2- (naphthalen- 1- yloxy)ethyl]piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCOc1cccc2c1cccc2

STK527857
Synonyms: 8- bromo- 3- [2- (morpholin- 4- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCOCC1

STK527859
Synonyms: 1- (4- ethoxyphenyl)- 2- phenyl- 3- (piperidin- 1- yl)propan- 1- ol
Smiles: CCOc1ccc(cc1)C(C(c1ccccc1)CN1CCCCC1)O

STK527860
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(4- fluorophenyl)amino]propan- 2- yl}pyridine- 3- carboxamide
Smiles: Fc1ccc(cc1)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1

STK527862
Synonyms: methyl3- {[(4- benzylpiperidin- 1- yl)acetyl]amino}- 5- bromo- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cc(cc2)Br

STK527863
Synonyms: 2- oxo- N- phenyl- 1- oxaspiro[4.5]decane- 4- carboxamide
Smiles: O=C(C1CC(=O)OC21CCCCC2)Nc1ccccc1

STK527864
Synonyms: 3- acetyl- 6- bromo- 1,3- benzoxazol- 2(3H)- one
Smiles: Brc1ccc2c(c1)oc(=O)n2C(=O)C

STK527865
Synonyms: N- (2- benzyl- 4- oxoquinazolin- 3(4H)- yl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: O=c1[nH]c2ccccc2c(c1C(=O)Nn1c(Cc2ccccc2)nc2c(c1=O)cccc2)O

STK527866
Synonyms: 3- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CC(c1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1)C

STK527867
Synonyms: 2- (4- chlorophenyl)- 4- [(2E)- 2- (3- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527868
Synonyms: (2Z)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(5- chloro- 2- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1OC)/c1scc(n1)c1ccc(cc1)Br

STK527869
Synonyms: 2- [2- (4- ethoxyphenyl)- 9H- imidazo[1,2- a]benzimidazol- 9- yl]- N,N- diethylethanamine
Smiles: CCOc1ccc(cc1)c1nc2n(c1)c1c(n2CCN(CC)CC)cccc1

STK527870
Synonyms: 2- (3,4- dichlorophenyl)- N- (2- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1ccccc1Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527871
Synonyms: 2- oxopyrido[1,2- a][1,3]thiazolo[5,4- e]pyrimidin- 10- ium- 1- ide
Smiles: O=c1sc2c([n-]1)[n+]1ccccc1nc2

STK527872
Synonyms: 3- (biphenyl- 4- yl)- 5- (3,4- dimethoxyphenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: COc1ccc(cc1OC)C1CC(=NN1c1ccccc1)c1ccc(cc1)c1ccccc1

STK527875
Synonyms: 3- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccccc1O

STK527876
Synonyms: N,N'- propane- 1,2- diylbis(2- nitrobenzenesulfonamide)
Smiles: CC(NS(=O)(=O)c1ccccc1[N+](=O)[O-])CNS(=O)(=O)c1ccccc1[N+](=O)[O-]

STK527877
Synonyms: ethyl(2- {[(1- hexyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)carbonyl]amino}- 1,3- thiazol- 4- yl)acetate
Smiles: CCCCCCn1c(=O)c(C(=O)Nc2scc(n2)CC(=O)OCC)c(c2c1cccc2)O

STK527879
Synonyms: (2E)- 1- (6- bromo- 2- methyl- 4- phenylquinolin- 3- yl)- 3- (3- methoxyphenyl)prop- 2- en- 1- one
Smiles: COc1cccc(c1)/C=C/C(=O)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Br

STK527881
Synonyms: methyl5- chloro- 3- {[(3,3- dimethylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)(C)C)cc(cc2)Cl

STK527882
Synonyms: 4- (4- bromophenoxy)- N- [(1Z)- 8- methoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: COc1ccc2c(c1)c1/c(=N/c3ccc(cc3)Oc3ccc(cc3)Br)/ssc1C(N2)(C)C

STK527884
Synonyms: 8- [(2- chloroethyl)sulfanyl]- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCl)nc2c1c(=O)[nH]c(=O)n2C

STK527885
Synonyms: (5E)- 3- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 5- {[5- (2- nitrophenyl)furan- 2- yl]methylidene}- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: [O-][N+](=O)c1ccccc1c1ccc(o1)/C=C\1/SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C

STK527888
Synonyms: 5- [(octadecylamino)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCCCCCCCCCCCCCCCNC=C1C(=O)NC(=O)NC1=O

STK527889
Synonyms: 4- methyl- 1- (1- methyl- 4- nitro- 1H- imidazol- 5- yl)piperidine
Smiles: CC1CCN(CC1)c1n(C)cnc1[N+](=O)[O-]

STK527890
Synonyms: N- [(E)- {4- methoxy- 3- [(3- methyl- 4- nitrophenoxy)methyl]phenyl}methylidene]- 4H- 1,2,4- triazol- 3- amine
Smiles: COc1ccc(cc1COc1ccc(c(c1)C)[N+](=O)[O-])/C=N/c1nnc[nH]1

STK527892
Synonyms: 2- {2- methyl- 1- oxo- 1- [(triethylstannanyl)oxy]propan- 2- yl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CC[Sn](OC(=O)C(N1C(=O)c2c(C1=O)cccc2)(C)C)(CC)CC

STK527893
Synonyms: 7- (3- methoxybenzyl)- 1,3- dimethyl- 8- phenoxy- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1cccc(c1)Cn1c(Oc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C

STK527895
Synonyms: O,O'- (9,10- dioxo- 9,10- dihydroanthracene- 1,2- diyl)bis{[(4- chlorophenyl)carbonyl]carbamothioate}
Smiles: Clc1ccc(cc1)C(=O)NC(=S)Oc1ccc2c(c1OC(=S)NC(=O)c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1

STK527897
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- [4- (4- nitrobenzyl)piperazin- 1- yl]ethanone
Smiles: [O-][N+](=O)c1ccc(cc1)CN1CCN(CC1)CC(=O)c1c(C)n(c2c1cccc2)C

STK527898
Synonyms: ethyl4- (hexylamino)- 2- oxo- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC

STK527899
Synonyms: 2- (3- ethoxy- 4- hydroxyphenyl)- 3- (2- methoxyphenyl)- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: CCOc1cc(ccc1O)C1Nc2ccccc2C(=O)N1c1ccccc1OC

STK527900
Synonyms: prop- 2- en- 1- yl(2,4,5- trichlorophenyl)carbamate
Smiles: Clc1cc(Cl)c(cc1NC(=O)OCC=C)Cl

STK527901
Synonyms: 2- amino- 4- (4- butoxyphenyl)- 6- (prop- 2- en- 1- ylsulfanyl)pyridine- 3,5- dicarbonitrile
Smiles: CCCCOc1ccc(cc1)c1c(C#N)c(N)nc(c1C#N)SCC=C

STK527902
Synonyms: 4- [(E)- {2- [(2E)- 2- (4- hydroxy- 3- methoxybenzylidene)hydrazinyl]- 4- phenyl- 1,3- selenazol- 5- yl}diazenyl]benzenesulfonamide
Smiles: COc1cc(/C=N/Nc2[se]c(c(n2)c2ccccc2)/N=N/c2ccc(cc2)S(=O)(=O)N)ccc1O

STK527903
Synonyms: 5,5- diphenyl- 3- (trimethylstannanyl)imidazolidine- 2,4- dione
Smiles: O=C1N(C(=O)NC1(c1ccccc1)c1ccccc1)[Sn](C)(C)C

STK527904
Synonyms: 7- hexadecyl- 3- methyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(S)nc2c1c(=O)[nH]c(=O)n2C

STK527905
Synonyms: ethyl3- ({[4- (4- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)F

STK527906
Synonyms: 3- (3- chloro- 4- fluorophenyl)- 1- (5,5- dimethyl- 4,5- dihydro- 1,3- thiazol- 2- yl)- 1- (2- methylphenyl)urea
Smiles: O=C(N(c1ccccc1C)C1=NCC(S1)(C)C)Nc1ccc(c(c1)Cl)F

STK527907
Synonyms: 7- bromo- 6- (4- bromophenyl)- 2,3- diphenylimidazo[1,2- b][1,2,4]triazine
Smiles: Brc1ccc(cc1)c1nc2n(c1Br)nc(c(n2)c1ccccc1)c1ccccc1

STK527908
Synonyms: N- {4- tert- butyl- 1- [1- (2- methylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- 4- methyl- N- nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1ccccc1C)c1ccc(cc1)C

STK527909
Synonyms: 1- methyl- 1H- indole- 7- carbohydrazide
Smiles: NNC(=O)c1cccc2c1n(C)cc2

STK527910
Synonyms: 8- {(2E)- 2- [1- (2- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(=O)[nH]c(=O)n2C

STK527912
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c[nH]c2c1cc(OC)cc2

STK527913
Synonyms: 3- (morpholin- 4- ylcarbonyl)- 8- nitro- 2H- chromen- 2- one
Smiles: O=C(c1cc2cccc(c2oc1=O)[N+](=O)[O-])N1CCOCC1

STK527915
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C

STK527916
Synonyms: 2- (4- chlorophenyl)- N- [2- (trifluoromethyl)phenyl]quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2ccccc2C(F)(F)F)c2c(n1)cccc2

STK527917
Synonyms: 8- methyl- 3- [2- (piperidin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCCCC1

STK527918
Synonyms: N- (4- chlorophenyl)- 2- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527919
Synonyms: 1- (1H- indol- 3- yl)- 2- (3- methylpiperidin- 1- yl)ethanol
Smiles: CC1CCCN(C1)CC(c1c[nH]c2c1cccc2)O

STK527921
Synonyms: 6- bromo- 2- {(2Z)- 2- [1- (5- bromofuran- 2- yl)ethylidene]hydrazinyl}- 4- phenylquinoline
Smiles: Brc1ccc(o1)/C(=N\Nc1nc2ccc(cc2c(c1)c1ccccc1)Br)/C

STK527922
Synonyms: 8- [(2E)- 2- (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(N/N=C\2/C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)[nH]c(=O)n2C

STK527923
Synonyms: 8- bromo- 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCOc1ccc(cc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527925
Synonyms: N- (naphthalen- 1- yl)- 2- (5H- [1,2,4]triazino[5,6- b]indol- 3- yl)hydrazinecarboxamide
Smiles: O=C(Nc1cccc2c1cccc2)NNc1nnc2c(n1)[nH]c1c2cccc1