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

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STK527265
Synonyms: 2,3- di(piperidin- 1- yl)- 6- (piperidin- 1- ylsulfonyl)naphthalene- 1,4- dione
Smiles: O=C1C(=C(N2CCCCC2)C(=O)c2c1ccc(c2)S(=O)(=O)N1CCCCC1)N1CCCCC1

STK527267
Synonyms: 6- chloro- 3- (2,3- dibromopropanoyl)- 1,3- benzoxazol- 2(3H)- one
Smiles: BrCC(C(=O)n1c(=O)oc2c1ccc(c2)Cl)Br

STK527269
Synonyms: (3aS,6aS)- 5- benzyl- 3- [(4- fluorophenyl)carbonyl]- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)C(=O)C1=NN[C@H]2[C@@H]1C(=O)N(C2=O)Cc1ccccc1

STK527270
Synonyms: N- benzyl- 2- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(NCc2ccccc2)c2c(n1)cccc2

STK833739
Synonyms: 3,7- dimethyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCC1

STK527271
Synonyms: (2E)- 3- [(3,4- dichlorophenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1ccccc1

STK833741
Synonyms: (2Z)- 3- [(2,5- dimethylphenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1C)/c1scc(n1)c1ccc(cc1)F

STK527274
Synonyms: 4- (4- phenylpiperazin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: c1ccc(cc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK527279
Synonyms: 1- (4- benzylpiperazin- 1- yl)- 3- (3,6- dibromo- 9H- carbazol- 9- yl)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CN1CCN(CC1)Cc1ccccc1

STK527285
Synonyms: (2E)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(2- iodophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK527287
Synonyms: (2E)- 3- [(4- methoxyphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)OC)/c1scc(n1)c1ccc(cc1)C

STK833747
Synonyms: (2Z)- 3- {[2- chloro- 5- (trifluoromethyl)phenyl]amino}- 2- cyanoprop- 2- enethioamide
Smiles: N#C/C(=C/Nc1cc(ccc1Cl)C(F)(F)F)/C(=S)N

STK527295
Synonyms: ethyl3- [(1,4- dioxa- 8- azaspiro[4.5]dec- 8- ylacetyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC3(CC1)OCCO3)cc(cc2)F

STK527296
Synonyms: 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(CCC2=CCCCC2)cnc2c1[nH]c1c2cccc1

STK833751
Synonyms: 2- {phenyl[4- (propan- 2- yl)phenyl]methylidene}- 1H- indene- 1,3(2H)- dione
Smiles: CC(c1ccc(cc1)/C(=C/1\C(=O)c2c(C1=O)cccc2)/c1ccccc1)C

STK833752
Synonyms: 1- (3,4- dichlorophenyl)- 2- (2- imino- 3- methyl- 2,3- dihydro- 1H- benzimidazol- 1- yl)ethanol
Smiles: OC(c1ccc(c(c1)Cl)Cl)Cn1c(=N)n(c2c1cccc2)C

STK527307
Synonyms: N'- benzyl- N'- phenyl- 2- (pyrrolidin- 1- yl)acetohydrazide
Smiles: O=C(NN(c1ccccc1)Cc1ccccc1)CN1CCCC1

STK527310
Synonyms: 2- [(3- cyano- 4- ethyl- 7,7- dimethyl- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl)sulfanyl]acetamide
Smiles: CCC1C(=C(SCC(=O)N)NC2=C1C(=O)CC(C2)(C)C)C#N

STK833755
Synonyms: N- tert- butyl- 6- oxo- 6H- anthra[1,9- cd][1,2]oxazole- 3- carboxamide
Smiles: O=C(c1ccc2c3c1noc3c1c(C2=O)cccc1)NC(C)(C)C

STK833756
Synonyms: 2- hydrazinyl- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4- amine
Smiles: NNc1nc(N)c2c(n1)c1ccccc1CC12CCCCC1

STK527313
Synonyms: (2E)- 3- [(3,4- dichlorophenyl)amino]- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1ccc(c(c1)C)C

STK833758
Synonyms: N- (2- hydroxyethyl)- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: OCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK527315
Synonyms: 6- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 3- methyl[1,2,4]triazolo[4,3- b]pyridazine
Smiles: Cc1cc(n(n1)c1ccc2n(n1)c(C)nn2)C

STK833760
Synonyms: 7- (3- bromobenzyl)- 3- methyl- 8- (pentylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527318
Synonyms: 2- (2- ethylpiperidin- 1- yl)- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: CCC1CCCCN1CC(=O)c1c(C)n(c2c1cc(OC)cc2)C

STK527319
Synonyms: N- (pentabromobenzyl)aniline
Smiles: Brc1c(CNc2ccccc2)c(Br)c(c(c1Br)Br)Br

STK833761
Synonyms: 3- methyl- 7- pentyl- 8- (prop- 2- en- 1- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(SCC=C)nc2c1c(=O)[nH]c(=O)n2C

STK527323
Synonyms: (2E)- 3- [(3- bromophenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527324
Synonyms: 2- hydroxy- 2,2- diphenyl- N'- (phenylsulfonyl)acetohydrazide
Smiles: O=C(C(c1ccccc1)(c1ccccc1)O)NNS(=O)(=O)c1ccccc1

STK833765
Synonyms: 8- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(SC/C=C(/Cl)\C)nc2c1c(=O)[nH]c(=O)n2C)C

STK833766
Synonyms: 1,3,4,6,8- pentamethyl- 5- phenylhexahydropyrimido[4,5- d]pyrimidine- 2,7(1H,3H)- dione
Smiles: O=C1N(C)C(C)C2C(N1C)N(C)C(=O)N(C2c1ccccc1)C

STK833767
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc(cc1)C

STK527333
Synonyms: (2Z)- 2- (hydroxyimino)- 2- (4- methyl- 1,3- thiazol- 2- yl)ethanamide
Smiles: Cc1csc(n1)/C(=N\O)/C(=O)N

STK833770
Synonyms: 7- amino- 9- (methylsulfanyl)- 8- azaspiro[4.5]deca- 6,9- diene- 6,10- dicarbonitrile
Smiles: N#CC1=C(SC)NC(=C(C21CCCC2)C#N)N

STK527340
Synonyms: (2E)- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)CC(C)C

STK833772
Synonyms: (2E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527342
Synonyms: (2E)- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 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)c1cc2c(oc1=O)ccc1c2cccc1

STK527343
Synonyms: 2,6- difluoro- N- ({2- [(3,3,3- trifluoropropyl)sulfanyl]phenyl}carbamoyl)benzamide
Smiles: O=C(NC(=O)c1c(F)cccc1F)Nc1ccccc1SCCC(F)(F)F

STK527345
Synonyms: 3- ({7- [(4- hydroxyphenyl)amino]- 4- nitro- 2,1,3- benzoxadiazol- 5- yl}amino)phenol
Smiles: Oc1ccc(cc1)Nc1cc(Nc2cccc(c2)O)c(c2c1non2)[N+](=O)[O-]

STK527346
Synonyms: (2E)- 3- [(2,4- dimethylphenyl)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(cc1C)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527347
Synonyms: 5- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 2- (ethylsulfanyl)- 6- hydroxy- 3- phenylpyrimidin- 4(3H)- one
Smiles: CCSc1nc(O)c(c(=O)n1c1ccccc1)C1OC(=O)c2c1ccc(c2OC)OC

STK833773
Synonyms: 3,3- dimethyl- 6- (trifluoromethyl)- 2,3,4,7- tetrahydro- 1H- indolo[2,3- c]quinolin- 1- one
Smiles: O=C1CC(C)(C)Cc2c1c1c(c(n2)C(F)(F)F)[nH]c2c1cccc2

STK833774
Synonyms: 1- [(3- chlorophenyl)amino]- 3- (3,6- dibromo- 9H- carbazol- 9- yl)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CNc1cccc(c1)Cl

STK527348
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK833775
Synonyms: ethyl4- {[2- (ethoxycarbonyl)- 2- ethylbutanoyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C(C(=O)OCC)(CC)CC

STK527349
Synonyms: 2- phenyl- 1- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: C1CCN(CC1)CCn1c(cn2c1nc1c2cccc1)c1ccccc1

STK527350
Synonyms: 2- {(E)- [(5- chloropyridin- 2- yl)imino]methyl}- 4- nitronaphthalen- 1- ol
Smiles: Clc1ccc(nc1)/N=C/c1cc([N+](=O)[O-])c2c(c1O)cccc2

STK527351
Synonyms: 2- (3- benzyl- 6- oxo- 1,4,5,6- tetrahydro- 1,2,4- triazin- 5- yl)- N'- [(1E)- 1- phenylethylidene]acetohydrazide(non- preferredname)
Smiles: O=C(CC1NC(=NNC1=O)Cc1ccccc1)N/N=C(/c1ccccc1)\C

STK833777
Synonyms: N- [(5- chloropyridin- 2- yl)carbamothioyl]- 2- {2- oxo- 5- [(propan- 2- yloxy)methyl]tetrahydrofuran- 3- yl}acetamide(non- preferredname)
Smiles: O=C(CC1CC(OC1=O)COC(C)C)NC(=S)Nc1ccc(cn1)Cl

STK833778
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [(2- methylphenyl)amino]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CNc1ccccc1C

STK833781
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(2- methoxyphenyl)amino]propan- 2- ol
Smiles: COc1ccccc1NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK833783
Synonyms: (2Z)- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1C)/c1scc(n1)c1ccc(c(c1)C)C

STK833784
Synonyms: 8- (ethylsulfanyl)- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C

STK833788
Synonyms: 5- [4,4- dimethyl- 1- (4- methylphenyl)- 3- oxopentyl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(C(=O)N1)C(c1ccc(cc1)C)CC(=O)C(C)(C)C

STK527368
Synonyms: 8- (ethylsulfanyl)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCC)nc2c1c(=O)[nH]c(=O)n2C

STK527369
Synonyms: N- (3,4- dichlorophenyl)- 2- (4- nitrophenyl)hydrazinecarboxamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)NNc1ccc(cc1)[N+](=O)[O-]

STK527375
Synonyms: methyl[2- (naphthalen- 1- yl)- 1,3- dioxo- 2,3- dihydro- 1H- inden- 2- yl]acetate
Smiles: COC(=O)CC1(C(=O)c2c(C1=O)cccc2)c1cccc2c1cccc2

STK527376
Synonyms: N- [4- (1,3- dioxo- 2,3- dihydro- 1H- inden- 2- yl)phenyl]propanamide
Smiles: CCC(=O)Nc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2

STK833793
Synonyms: (2Z)- 3- [(2,3- dichlorophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK833794
Synonyms: (2Z,4E)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]- 5- phenylpenta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccccc1)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK833797
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2,5- dimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)ccc1OC)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527384
Synonyms: ethyl2- ({4- [(2,6- dimethoxypyrimidin- 4- yl)sulfamoyl]phenyl}amino)- 3,3,3- trifluoro- N- {[3- (trifluoromethyl)phenyl]carbonyl}alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)C(F)(F)F)Nc1ccc(cc1)S(=O)(=O)Nc1cc(OC)nc(n1)OC

STK833801
Synonyms: 4- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: COc1ccc(cc1)/C=N/Nc1nc2ccccc2n2c1nnc2

STK527389
Synonyms: 4- (furan- 2- yl)- 6- phenyl- 2- sulfanylpyridine- 3- carbonitrile
Smiles: N#Cc1c(S)nc(cc1c1ccco1)c1ccccc1

STK527390
Synonyms: 1- (5- methoxy- 1H- indol- 3- yl)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK527392
Synonyms: N- butyl- 2- (phenylamino)pyridine- 3- carboxamide
Smiles: CCCCNC(=O)c1cccnc1Nc1ccccc1

STK527393
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)serine
Smiles: OCC(C(=O)O)NC1CCS(=O)(=O)C1

STK527395
Synonyms: 6- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 5- cyano- 4- (furan- 2- yl)- N- (2- methoxyphenyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Br)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK833805
Synonyms: 2- {[7- (2- methoxyethyl)- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}acetamide
Smiles: COCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK527398
Synonyms: (2Z)- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc(cc1)CC

STK527404
Synonyms: (2E)- 3- [(3,4- dichlorophenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1ccc(cc1)CC(C)C

STK527405
Synonyms: 4- (4- butoxyphenyl)- 5- cyano- 2- methyl- 6- {[2- oxo- 2- (2- oxo- 2H- chromen- 3- yl)ethyl]sulfanyl}- N- phenylpyridine- 3- carboxamide
Smiles: CCCCOc1ccc(cc1)c1c(C#N)c(SCC(=O)c2cc3ccccc3oc2=O)nc(c1C(=O)Nc1ccccc1)C

STK833810
Synonyms: 2- methyl- 4- {(E)- [2- ([1,2,4]triazolo[4,3- a]quinoxalin- 4- yl)hydrazinylidene]methyl}benzene- 1,3- diol
Smiles: Oc1ccc(c(c1C)O)/C=N/Nc1nc2ccccc2n2c1nnc2

STK527409
Synonyms: methyl5- bromo- 3- {[(4- carbamoylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CC[C@H](CC1)C(=O)N)cc(cc2)Br

STK527412
Synonyms: 2,2'- (1,2,4- thiadiazole- 3,5- diyldisulfanediyl)bis[N- (4- methylphenyl)acetamide]
Smiles: O=C(Nc1ccc(cc1)C)CSc1nsc(n1)SCC(=O)Nc1ccc(cc1)C

STK527413
Synonyms: N- tert- butyl- 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)NC(C)(C)C)C

STK833814
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527417
Synonyms: 2- (2,4- dichlorophenyl)- N- (2,4- dimethoxyphenyl)quinazolin- 4- amine
Smiles: COc1cc(OC)ccc1Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK527418
Synonyms: 3- [(2,3- dihydro- 1- benzofuran- 2- ylmethyl)(methyl)amino]propanenitrile
Smiles: N#CCCN(CC1Cc2c(O1)cccc2)C

STK833816
Synonyms: 7- benzyl- 8- (ethylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK527425
Synonyms: 1- {2- oxo- 2- [(trimethylstannanyl)oxy]ethyl}pyrrolidine- 2,5- dione
Smiles: O=C(O[Sn](C)(C)C)CN1C(=O)CCC1=O

STK527428
Synonyms: N- (3- fluorophenyl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1c(C)cc(=O)oc1C

STK527429
Synonyms: propyl4- {[{[3- (dimethylamino)propyl]amino}(oxo)acetyl]amino}benzoate
Smiles: CCCOC(=O)c1ccc(cc1)NC(=O)C(=O)NCCCN(C)C

STK527431
Synonyms: 1,3- bis(3- chlorophenyl)- 1- (5,5- dimethyl- 4,5- dihydro- 1,3- thiazol- 2- yl)urea
Smiles: Clc1cccc(c1)NC(=O)N(C1=NCC(S1)(C)C)c1cccc(c1)Cl

STK527433
Synonyms: 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCOc1ccc(cc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK527435
Synonyms: 2- (3- benzyl- 6- oxo- 1,4,5,6- tetrahydro- 1,2,4- triazin- 5- yl)- N'- [(1E)- 1- (4- methylphenyl)ethylidene]acetohydrazide(non- preferredname)
Smiles: O=C(CC1NC(=NNC1=O)Cc1ccccc1)N/N=C(/c1ccc(cc1)C)\C

STK527439
Synonyms: (2E)- 3- {[2- chloro- 5- (trifluoromethyl)phenyl]amino}- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(ccc1Cl)C(F)(F)F)/c1scc(n1)c1ccc(cc1Cl)Cl

STK527440
Synonyms: {1- [(1Z)- 3- (4- bromophenyl)- 1- (furan- 2- yl)- 3- oxoprop- 1- en- 2- yl]pyridin- 2(1H)- ylidene}propanedinitrile
Smiles: N#CC(=c1ccccn1/C(=C\c1ccco1)/C(=O)c1ccc(cc1)Br)C#N

STK527441
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)ethanone
Smiles: O=C(c1c(C)n(c2c1cccc2)C)CN1CCC2(CC1)OCCO2

STK833821
Synonyms: (2E)- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC)/c1scc(n1)c1ccc(cc1C)C

STK527443
Synonyms: methyl[4- ({2- [(1- ethyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)carbonyl]hydrazinyl}sulfonyl)phenyl]carbamate
Smiles: COC(=O)Nc1ccc(cc1)S(=O)(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)CC

STK833824
Synonyms: 7- chloro- 5- methoxy- 4- nitro- 2,1,3- benzoxadiazole
Smiles: COc1cc(Cl)c2c(c1[N+](=O)[O-])non2

STK527449
Synonyms: 1- hexyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCCCCCn1cc(C(=O)O)c(=O)c2c1cccc2

STK527453
Synonyms:
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)NNC(=O)C1[C@@H]2[C@H]1CCCC2

STK527456
Synonyms: dipropan- 2- yl[1- (4- chlorophenyl)- 1H- 1,2,4- triazol- 3- yl]phosphonate
Smiles: CC(OP(=O)(c1ncn(n1)c1ccc(cc1)Cl)OC(C)C)C

STK527458
Synonyms: 2,2,3,3,4,4,4- heptafluoro- N- (3,4,5- trimethoxybenzyl)butanamide
Smiles: COc1cc(CNC(=O)C(C(C(F)(F)F)(F)F)(F)F)cc(c1OC)OC

STK833828
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK833831
Synonyms: (2Z)- 3- [(2,4- dimethoxyphenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1OC)OC)/c1scc(n1)c1ccc(cc1)F

STK527466
Synonyms: 2- ({(E)- [2- hydroxy- 3- (prop- 2- en- 1- yl)phenyl]methylidene}amino)ethanesulfonicacid
Smiles: C=CCc1cccc(c1O)/C=N/CCS(=O)(=O)O

STK527471
Synonyms: 3- [(2- fluoro- 5- methylphenyl)amino]- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1cc(C)ccc1F

STK833835
Synonyms: 2- (4- methoxyphenyl)- 4- phenyl- 2,3- dihydro- 1,5- benzothiazepine
Smiles: COc1ccc(cc1)C1CC(=Nc2c(S1)cccc2)c1ccccc1

STK833836
Synonyms: 3- (1H- benzimidazol- 2- yl)- 4- hydroxyquinolin- 2(1H)- one
Smiles: O=c1[nH]c2ccccc2c(c1c1nc2c([nH]1)cccc2)O

STK527477
Synonyms: N- (2- fluorophenyl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1ccccc1F

STK833839
Synonyms: 2- (methylsulfanyl)- 4- (4- nitrophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SC)NC(=O)CC1c1ccc(cc1)[N+](=O)[O-]

STK833840
Synonyms: 9- (prop- 2- en- 1- yl)- 2- (thiophen- 2- yl)- 9H- imidazo[1,2- a]benzimidazole
Smiles: C=CCn1c2nc(cn2c2c1cccc2)c1cccs1

STK833841
Synonyms: 3- (morpholin- 4- yl)- 1- phenylpropan- 1- one
Smiles: O=C(c1ccccc1)CCN1CCOCC1

STK527479
Synonyms: 1- (5- methylthiophen- 2- yl)- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethanone
Smiles: O=C(c1ccc(s1)C)CC12CC3CC(C2)CC(C1)C3

STK527481
Synonyms: 4- ethoxy- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)- N- phenylbenzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1ccccc1)C

STK527487
Synonyms: methyl3- {[3- (4- cyclohexylpiperazin- 1- yl)propanoyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)C1CCCCC1)cc(cc2)C

STK527489
Synonyms: 2- [(3- cyano- 4,6- diphenylpyridin- 2- yl)sulfanyl]- N'- [(E)- (2- hydroxy- 3- nitro- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 1- yl)methylidene]acetohydrazide
Smiles: N#Cc1c(SCC(=O)N/N=C/c2c3c(oc4c3CCCC4)cc(c2O)[N+](=O)[O-])nc(cc1c1ccccc1)c1ccccc1

STK833845
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(3- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)OC)/c1scc(n1)c1cccc(c1)Br

STK833847
Synonyms: 4- hydroxy- N- (4- iodophenyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Ic1ccc(cc1)NC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK527495
Synonyms: ethyl3- ({[4- (ethoxycarbonyl)piperazin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC

STK527497
Synonyms: 3- fluoro- N- [(1Z)- 4,4,7- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: Cc1ccc2c(c1)NC(c1c2/c(=N/c2cccc(c2)F)/ss1)(C)C

STK527499
Synonyms: ethyl1- (2,3- dimethoxybenzyl)- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)c1cc(n(c1C)Cc1cccc(c1OC)OC)C

STK527500
Synonyms: 6- fluoro- 1,2,4- triazine- 3,5(2H,4H)- dione
Smiles: Fc1n[nH]c(=O)[nH]c1=O

STK833849
Synonyms: methyl6- chloro- 2,4- bis(trifluoromethyl)- 3,4- dihydroquinazoline- 4- carboxylate
Smiles: COC(=O)C1(NC(=Nc2c1cc(Cl)cc2)C(F)(F)F)C(F)(F)F

STK527502
Synonyms: 2- {[3- (ethylamino)- 3- oxopropanoyl]amino}benzoicacid
Smiles: CCNC(=O)CC(=O)Nc1ccccc1C(=O)O

STK833850
Synonyms: 9- oxo- 7- {[2- oxo- 2- (2- oxo- 2H- chromen- 3- yl)ethyl]sulfanyl}- 8- azaspiro[4.5]dec- 6- ene- 6,10- dicarbonitrile
Smiles: N#CC1C(=O)NC(=C(C21CCCC2)C#N)SCC(=O)c1cc2ccccc2oc1=O

STK527503
Synonyms: 8- {4- [2- (1H- indol- 3- yl)- 2- oxoethyl]piperazin- 1- yl}- 3- methyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK833851
Synonyms: 8- {(2E)- 2- [(2E)- 2- bromo- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}- 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/C(=C\c2ccccc2)/Br)nc2c1c(=O)[nH]c(=O)n2C

STK527504
Synonyms: [5- (thiophen- 2- ylcarbonyl)thiophen- 2- yl]aceticacid
Smiles: OC(=O)Cc1ccc(s1)C(=O)c1cccs1

STK527506
Synonyms: 2- {[5- (ethoxymethyl)- 2- methylpyrimidin- 4- yl]amino}- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: CCOCc1cnc(nc1NCC(=O)c1c[nH]c2c1cc(OC)cc2)C

STK527507
Synonyms: 8- (dimethylamino)- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)C

STK833853
Synonyms: 2- (4- hydroxyphenyl)hexahydro- 1H- benzimidazole- 1,3(2H)- diol
Smiles: ON1C2CCCCC2N(C1c1ccc(cc1)O)O

STK833854
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(4- methoxyphenyl)amino]propan- 2- ol
Smiles: COc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK833855
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- {[4- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)C(C)C)/C#N

STK527510
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)C)C)/c1scc(n1)c1ccc(cc1)Cl

STK527511
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 8- (pentylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCSc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C

STK833856
Synonyms: 5- [(E)- phenyldiazenyl]- 2,1,3- benzoxadiazol- 4- amine
Smiles: Nc1c(/N=N/c2ccccc2)ccc2c1non2

STK527512
Synonyms: methyl5- chloro- 3- ({[(3S)- 3- (2- ethoxy- 2- oxoethyl)- 2- oxopiperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C[C@@H]1NCCN(C1=O)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK833857
Synonyms: 1- (3,4- dichlorophenyl)- 2- [2- imino- 3- (4- methylbenzyl)- 2,3- dihydro- 1H- benzimidazol- 1- yl]ethanone
Smiles: Cc1ccc(cc1)Cn1c2ccccc2n(c1=N)CC(=O)c1ccc(c(c1)Cl)Cl

STK527516
Synonyms: 6- hydroxy- 2- imino- 1,3- diphenyl- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Oc1cc(=O)n(c(=N)n1c1ccccc1)c1ccccc1

STK527517
Synonyms: dibutyl2,2'- (5- methyl- 2- oxo- 1H- benzimidazole- 1,3(2H)- diyl)diacetate
Smiles: CCCCOC(=O)Cn1c2cc(C)ccc2n(c1=O)CC(=O)OCCCC

STK527520
Synonyms: (2Z)- 3- [(4- ethylphenyl)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)CC)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK833861
Synonyms: 7- ethyl- 3- methyl- 8- [(2- oxo- 2- phenylethyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK833862
Synonyms: 4- ethyl- 5,5- dimethyl- 2- phenyl- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: CCC1=[N+]([O-])C(N(C1(C)C)O)c1ccccc1

STK833863
Synonyms: (2E)- 3- [(3,4- dimethylphenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=C/Nc1ccc(c(c1)C)C)/C#N

STK833865
Synonyms: (2E)- 3- [(2- methoxyphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK527532
Synonyms: 3- [(2- methyl- 1,3- oxathiolan- 2- yl)methyl]- 1H- indole
Smiles: CC1(OCCS1)Cc1c[nH]c2c1cccc2

STK833866
Synonyms: 8- methyl- 4,5- dihydro[1,2,5]oxadiazolo[3,4- f]cinnoline
Smiles: Cc1nnc2c(c1)c1nonc1CC2

STK833867
Synonyms: (2Z)- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccccc1

STK833870
Synonyms: 2- amino- 4- [5- (4- bromophenyl)furan- 2- yl]- 5- oxo- 5,6,7,8- tetrahydro- 4H- chromene- 3- carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccc(o1)c1ccc(cc1)Br)C(=O)CCC2

STK833876
Synonyms: (2E)- 3- [(4- ethoxyphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)[N+](=O)[O-])\C#N

STK527545
Synonyms: {[3- cyano- 4,6- bis(4- methoxyphenyl)pyridin- 2- yl]sulfanyl}aceticacid
Smiles: COc1ccc(cc1)c1nc(SCC(=O)O)c(c(c1)c1ccc(cc1)OC)C#N

STK527546
Synonyms: (2Z)- 2- (3,5- dimethylcyclopent- 2- en- 1- ylidene)hydrazinecarbothioamide
Smiles: CC1CC(=C/C/1=N\NC(=S)N)C

STK527549
Synonyms: (2Z)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(4- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)C)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK833879
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (2,4- diethoxyphenyl)prop- 2- enenitrile
Smiles: CCOc1cc(OCC)ccc1/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N

STK527551
Synonyms: methyl3- [(N,N- dimethylglycyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN(C)C)cccc2

STK833881
Synonyms: (2Z,4E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 5- phenylpenta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccccc1)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK833883
Synonyms: (2E)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(3- bromophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK527557
Synonyms: (2E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 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)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK833885
Synonyms: N- [4,6- bis(dimethylamino)- 1,3,5- triazin- 2- yl]- 4- methyl- N- (4H- 1,2,4- triazol- 4- yl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(n1cnnc1)c1nc(nc(n1)N(C)C)N(C)C

STK833886
Synonyms: (2E)- 3- [(3,4- dimethylphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)C)C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK833891
Synonyms: (5E)- 5- (hydroxyimino)- 4- [(2E)- 2- (hydroxyimino)propyl]- 4,5,6,7- tetrahydro- 2,1,3- benzoxadiazol- 4- ol
Smiles: O/N=C(/CC1(O)/C(=N/O)/CCc2c1non2)\C

STK833892
Synonyms: 8- bromo- 7- [2- (4- chlorophenyl)- 2- oxoethyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)C(=O)Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK527563
Synonyms: (2E)- 3- [(4- butoxyphenyl)amino]- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(c(c1)C)C)\C#N

STK833895
Synonyms: 1- butyl- 3- pyridin- 2- ylurea
Smiles: CCCCNC(=O)Nc1ccccn1

STK527567
Synonyms: (1Z)- N- (oxiran- 2- ylmethoxy)acenaphthylen- 1(2H)- imine
Smiles: O(/N=C\1/Cc2c3c1cccc3ccc2)CC1CO1

STK527568
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1)C

STK527570
Synonyms: (ethoxycarbonyl)(3- methoxy- 4- methyl- 1,2,3- thiadiazol- 3- ium- 5- yl)azanide
Smiles: CCOC(=O)[N-]c1sn[n+](c1C)OC

STK527572
Synonyms: methyl4- [bis(4,4- dimethyl- 2,6- dioxocyclohexyl)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK833900
Synonyms: 8- bromo- 7- butyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK527575
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 2- (2- chlorophenyl)quinazoline
Smiles: Clc1ccccc1c1nc2ccccc2c(n1)N1CCC(CC1)Cc1ccccc1

STK833903
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 8- [(3- methylbutyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C)O

STK527581
Synonyms: 1- (4- acetylphenyl)- 2- amino- 6- methyl- 4,4- bis(trifluoromethyl)- 1,4- dihydropyridine- 3- carbonitrile
Smiles: N#CC1=C(N)N(C(=CC1(C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)C(=O)C

STK527583
Synonyms: 6- (2,6- dimethoxyphenoxy)- N- (tetrahydrofuran- 2- ylmethyl)hexan- 1- amine
Smiles: COc1cccc(c1OCCCCCCNCC1CCCO1)OC

STK527586
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- iodophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)I)/c1scc(n1)c1ccc(cc1)Br

STK527590
Synonyms: N,N- diethyl- 2- [2- (4- methylphenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]ethanamine
Smiles: CCN(CCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)C)CC

STK527594
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- (3- nitrobenzyl)ethanamine
Smiles: CC(C1COc2c(O1)cccc2)NCc1cccc(c1)[N+](=O)[O-]

STK527602
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- {[2- chloro- 5- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(ccc1Cl)C(F)(F)F)/c1scc(n1)c1cccc(c1)Br

STK527604
Synonyms: methyl3,3,3- trifluoro- N- (furan- 2- ylcarbonyl)- 2- hydroxyalaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)O

STK527610
Synonyms: 4,4'- sulfanediylbis(3- phenyl- 1,2,3- oxadiazol- 3- ium- 5- olate)
Smiles: [O-]c1on[n+](c1Sc1c([O-])on[n+]1c1ccccc1)c1ccccc1

STK833911
Synonyms: (2Z)- 3- [(2,5- dimethoxyphenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: COc1ccc(c(c1)N/C=C(\c1scc(n1)c1ccccc1)/C#N)OC

STK527611
Synonyms: 3- ({7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)propanoicacid
Smiles: CCc1ccc(cc1)OCC(Cn1c(SCCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C)O

STK527619
Synonyms: methyl3- {[N- (1,3- benzodioxol- 5- yl)- N- ethylglycyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: CCN(c1ccc2c(c1)OCO2)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK833917
Synonyms: N- [(E)- (3- {[4- chloro- 5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 4- methoxyphenyl)methylidene]- 4H- 1,2,4- triazol- 4- amine
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)/C=N/n1cnnc1

STK527620
Synonyms: 2- [(7- heptyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: CCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK527632
Synonyms: (2E)- 3- [(4- nitrophenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK833920
Synonyms: (2Z)- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)C)/c1scc(n1)c1ccc(cc1C)C

STK833921
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc(c(c1)C)C

STK527634
Synonyms: ethyl(2E)- 2- [(5- nitrofuran- 2- yl)methylidene]- 3- oxobutanoate
Smiles: CCOC(=O)/C(=C/c1ccc(o1)[N+](=O)[O-])/C(=O)C

STK833922
Synonyms: (2E)- 3- [(2- iodophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccc(cc1)C

STK833923
Synonyms: (2E)- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK527639
Synonyms: (2E)- 3- [(3,4- dimethylphenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)C)C)/c1scc(n1)c1ccccc1

STK527640
Synonyms: N- (3- chlorophenyl)- 2- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2cccc(c2)Cl)c2c(n1)cccc2

STK527641
Synonyms: 4- ({N- [(4- ethoxyphenyl)carbonyl]- beta- alanyl}amino)butanoicacid
Smiles: CCOc1ccc(cc1)C(=O)NCCC(=O)NCCCC(=O)O

STK833925
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)OC

STK833926
Synonyms: 3- methyl- 8- [(2- oxo- 2- phenylethyl)sulfanyl]- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK833927
Synonyms: ethyl2- {[7- (3- bromobenzyl)- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C)C

STK527646
Synonyms: 5- (furan- 2- yl)- 3,3- dimethyl- 3,4,5,6- tetrahydrobenzo[a]phenanthridin- 1(2H)- one
Smiles: O=C1CC(C)(C)CC2=C1c1c(NC2c2ccco2)ccc2c1cccc2

STK527648
Synonyms: 6,7- dimethoxy- 3- (naphthalen- 2- ylamino)- 2- benzofuran- 1(3H)- one
Smiles: COc1ccc2c(c1OC)C(=O)OC2Nc1ccc2c(c1)cccc2

STK527649
Synonyms: (2E)- 3- [(4- chlorophenyl)amino]- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Cl)/c1scc(n1)c1ccc(cc1Cl)Cl

STK527650
Synonyms: methyl[(6- methyl- 1,3- benzothiazol- 2- yl)amino](oxo)acetate
Smiles: COC(=O)C(=O)Nc1nc2c(s1)cc(cc2)C

STK833933
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 3- methyl- 8- [(2- methylpropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(SCC(C)C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl

STK833934
Synonyms: 6- (morpholin- 4- ylmethyl)- 6H- indolo[2,3- b]quinoxaline
Smiles: O1CCN(CC1)Cn1c2ccccc2c2c1nc1ccccc1n2

STK833935
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (4- methylphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)C)/c1scc(n1)c1ccc2c(c1)OCO2

STK527651
Synonyms: (2E)- 3- [(4- chlorophenyl)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)Cl)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK833936
Synonyms: 8- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)C(=O)CSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK833937
Synonyms: 1- (4- ethoxyphenyl)- 2- [2- imino- 3- (prop- 2- en- 1- yl)- 2,3- dihydro- 1H- benzimidazol- 1- yl]ethanol
Smiles: C=CCn1c(=N)n(c2c1cccc2)CC(c1ccc(cc1)OCC)O

STK527655
Synonyms: (2Z)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]- 3- [4- (propan- 2- yl)phenyl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)C(C)C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK527661
Synonyms: chloro(dipiperidin- 1- ylphosphoryl)acetaldehyde
Smiles: O=CC(P(=O)(N1CCCCC1)N1CCCCC1)Cl

STK527668
Synonyms: 10- aminodecahydroacridine- 4a,10a(2H,10H)- dicarbonitrile
Smiles: N#CC12CCCCC1CC1C(N2N)(C#N)CCCC1

STK527672
Synonyms: 2- [4- (2- methoxyphenyl)piperazin- 1- yl]- 1- (2- methyl- 1H- indol- 3- yl)ethanol
Smiles: COc1ccccc1N1CCN(CC1)CC(c1c(C)[nH]c2c1cccc2)O

STK527675
Synonyms: 1,5- dimethyl- 2- phenyl- 4- [phenyl(pyridin- 2- ylamino)methyl]- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: O=c1n(c2ccccc2)n(c(c1C(c1ccccc1)Nc1ccccn1)C)C

STK833945
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)Cl

STK833946
Synonyms: 8- {(2E)- 2- [(2Z)- 2- bromo- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(N/N=C/C(=C/c2ccccc2)/Br)nc2c1c(=O)[nH]c(=O)n2C

STK833948
Synonyms: 3,5- di(morpholin- 4- yl)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1c(cc(c3no2)N1CCOCC1)N1CCOCC1

STK527677
Synonyms: ethyl1- [2- (2- methyl- 1H- indol- 3- yl)- 2- oxoethyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cccc2

STK833952
Synonyms: 1- (3,6- dichloro- 9H- carbazol- 9- yl)- 3- [(2- methylphenyl)amino]propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)CNc1ccccc1C

STK527683
Synonyms: 2- (2- chlorophenyl)- N- cyclohexylquinazolin- 4- amine
Smiles: Clc1ccccc1c1nc(NC2CCCCC2)c2c(n1)cccc2

STK527684
Synonyms: 1,3- dimethyl- 4- {[(E)- phenylmethylidene]amino}tetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: CN1C2C(N(C1=O)C)NC(=O)N2/N=C/c1ccccc1

STK833953
Synonyms: (2E)- 3- [(2- iodophenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccccc1

STK527688
Synonyms: N- (3,4- dimethoxybenzyl)- 8- methoxy- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)NCc1ccc(c(c1)OC)OC

STK527689
Synonyms: (1Z)- 3- [({2- [(diaminomethylidene)amino]- 1,3- thiazol- 4- yl}methyl)sulfanyl]- N'- sulfamoylpropanimidamide
Smiles: NC(=Nc1scc(n1)CSCC/C(=N/S(=O)(=O)N)/N)N

STK527692
Synonyms: 2- methyl- 3- (propan- 2- yl)- 6- (pyrrolidin- 1- yl)hex- 4- yn- 3- ol
Smiles: CC(C(C(C)C)(C#CCN1CCCC1)O)C

STK833956
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (4- butoxyphenyl)prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N

STK833957
Synonyms: 1,1'- (1,3- dimethyl- 2- oxoimidazolidine- 4,5- diyl)bis(3- tert- butylurea)
Smiles: CN1C(NC(=O)NC(C)(C)C)C(N(C1=O)C)NC(=O)NC(C)(C)C

STK833958
Synonyms: 2- methyl- 3- (4- methylpiperidin- 1- yl)quinoxaline
Smiles: CC1CCN(CC1)c1nc2ccccc2nc1C

STK527698
Synonyms: 2- amino- 1- (3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)- 4,4- bis(trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- cyclopenta[b]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2sc(c(c2C#N)CC)C)C2=C(C1(C(F)(F)F)C(F)(F)F)CCC2

STK527701
Synonyms: (2Z)- 3- [(2,4- dichlorophenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1ccccc1

STK527702
Synonyms: N- [3- (diethylamino)propyl]- N'- (1,3- thiazol- 2- yl)ethanediamide
Smiles: CCN(CCCNC(=O)C(=O)Nc1nccs1)CC

STK527706
Synonyms: (2Z)- 3- [(2,4- dichlorophenyl)amino]- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK527707
Synonyms: (2Z)- 3- [(2,3- dichlorophenyl)amino]- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK833961
Synonyms: 1,4- dimethoxy- 4a- methyloctahydroquinoxaline- 2,3- dione
Smiles: CON1C(=O)C(=O)N(C2(C1CCCC2)C)OC

STK833962
Synonyms: (2Z)- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]- 3- (phenylamino)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK833963
Synonyms: 3,3'- [benzene- 1,4- diylbis(oxy)]bis[1- (phenylamino)propan- 2- ol]
Smiles: OC(COc1ccc(cc1)OCC(CNc1ccccc1)O)CNc1ccccc1

STK527708
Synonyms: 8- (ethylsulfanyl)- 3- methyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(SCC)nc2c1c(=O)[nH]c(=O)n2C

STK833967
Synonyms: 2- (4- ethoxyphenyl)- 1- ethyl- 8- methyl- 5,6- dihydrodipyrrolo[1,2- a:2',1'- c]pyrazine
Smiles: CCOc1ccc(cc1)c1cn2c(c1CC)c1ccc(n1CC2)C

STK527710
Synonyms: (9E)- 9- (2- carbamothioylhydrazinylidene)- 9H- fluorene- 4- carboxylicacid
Smiles: NC(=S)N/N=C/1\c2ccccc2c2c1cccc2C(=O)O

STK527712
Synonyms: 7- hydroxy- 6- methyl- 3- (4- methylphenoxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: Cc1ccc(cc1)Oc1c(=O)c2cc(C)c(cc2oc1C(F)(F)F)O

STK833972
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 1- yl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1cccc2c1cccc2)/c1scc(n1)c1ccc(cc1Cl)Cl

STK833974
Synonyms: (4E)- N- hydroxy- 2,2- dimethyl- 2,5,6,7- tetrahydro- 4H- benzimidazol- 4- imine1- oxide
Smiles: O/N=C/1\CCCC2=[N+](C(N=C12)(C)C)[O-]

STK527721
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- oxo- 3- azaspiro[5.5]undec- 1- ene- 1,5- dicarbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Cl)NC(=O)C(C21CCCCC2)C#N

STK527722
Synonyms: (2Z)- 3- (2- bromophenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1Br)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK833976
Synonyms: (2Z)- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(c(c1)C)C

STK527725
Synonyms: 1- (9H- carbazol- 9- yl)- 3- ethoxypropan- 2- ol
Smiles: CCOCC(Cn1c2ccccc2c2c1cccc2)O

STK833977
Synonyms: 2,6- di- tert- butyl- 4- [(2- hydroxyphenyl)(morpholin- 4- yl)methyl]phenol
Smiles: Oc1ccccc1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N1CCOCC1

STK527726
Synonyms: 2- (8- methyl- 3- oxo- 8- pentylhexahydro- 7H- [1,3]thiazolo[3,2- a]pyrazin- 7- yl)acetohydrazide
Smiles: CCCCCC1(C)N(CCN2C1SCC2=O)CC(=O)NN

STK527728
Synonyms: methyl3- ({[4- (2,3- dimethylphenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cccc2

STK527729
Synonyms: 2- (3,4- dichlorophenyl)- N- (3,4- dimethylphenyl)quinazolin- 4- amine
Smiles: Cc1ccc(cc1C)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527736
Synonyms: methyl6- (4- bromophenyl)- 3,5,5- trimethyl- 2,4- dioxotetrahydro- 2H- pyran- 3- carboxylate
Smiles: COC(=O)C1(C)C(=O)OC(C(C1=O)(C)C)c1ccc(cc1)Br

STK527746
Synonyms: 3- hexanoyl- 1,3- benzoxazol- 2(3H)- one
Smiles: CCCCCC(=O)n1c(=O)oc2c1cccc2

STK833992
Synonyms: N- [4,6- bis(dimethylamino)- 1,3,5- triazin- 2- yl]- N- cyano- 2- (2,4- dichlorophenoxy)acetamide
Smiles: N#CN(c1nc(nc(n1)N(C)C)N(C)C)C(=O)COc1ccc(cc1Cl)Cl

STK833998
Synonyms: 5- cyano- 6- (ethylsulfanyl)- 4- (4- hydroxyphenyl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1ccc(cc1)O

STK527755
Synonyms: [(3R)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl](10H- phenothiazin- 10- yl)methanone
Smiles: COc1cccc(c1)N1CCN(CC1C)C(=O)N1c2ccccc2Sc2c1cccc2

STK834003
Synonyms: 5,5,5',5'- tetramethyl- 4,4',5,5'- tetrahydro- 3,3'- bi- 1,2,4- oxadiazole
Smiles: CC1(C)ON=C(N1)C1=NOC(N1)(C)C

STK527759
Synonyms: dipropyl(acetylcarbamoyl)phosphoramidate
Smiles: CCCOP(=O)(NC(=O)NC(=O)C)OCCC

STK527762
Synonyms: N- (naphthalen- 1- ylcarbamoyl)phenylalanine
Smiles: O=C(Nc1cccc2c1cccc2)NC(C(=O)O)Cc1ccccc1

STK834004
Synonyms: N- ethyl- 6- oxo- 6H- anthra[1,9- cd][1,2]oxazole- 3- carboxamide
Smiles: CCNC(=O)c1ccc2c3c1noc3c1c(C2=O)cccc1

STK834005
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- [(E)- (3- nitrophenyl)methylidene]ethanamine
Smiles: CC(C1COc2c(O1)cccc2)/N=C/c1cccc(c1)[N+](=O)[O-]

STK527768
Synonyms: 4- {[(1E)- 3- (2,4- dimethoxyphenyl)- 3- oxoprop- 1- en- 1- yl]amino}- N- (5- ethyl- 1,3,4- thiadiazol- 2- yl)benzenesulfonamide
Smiles: COc1cc(OC)ccc1C(=O)/C=C/Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)CC

STK834006
Synonyms: (2E)- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 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)c1cc2ccccc2oc1=O

STK834008
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 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(cc1)Br

STK527771
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: O=C(c1c(C)n(c2c1cccc2)C)CN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK527772
Synonyms: 2- [3- (4- chlorobenzyl)- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl]- 1- (3,4- dichlorophenyl)ethanol
Smiles: Clc1ccc(cc1)Cn1c2ccccc2n(c1=N)CC(c1ccc(c(c1)Cl)Cl)O

STK527773
Synonyms: 1- [6- (2,6- dimethoxyphenoxy)hexyl]- 4- (diphenylmethyl)piperazine
Smiles: COc1cccc(c1OCCCCCCN1CCN(CC1)C(c1ccccc1)c1ccccc1)OC

STK527775
Synonyms: 4- ethoxy- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)- N- (3- methylphenyl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1cccc(c1)C)C

STK527778
Synonyms: 4- ({(E)- 2- cyano- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)N)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527779
Synonyms: (2Z)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(cc1)Cl

STK527782
Synonyms: (2Z)- 3- [(2,3- dichlorophenyl)amino]- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc(cc1)OC

STK834013
Synonyms: (2E)- 3- [(4- methylphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK527784
Synonyms: N- (4- ethylphenyl)- 2- {[4- hydroxy- 6- (trifluoromethyl)pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nc(O)cc(n1)C(F)(F)F

STK834018
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527788
Synonyms: N- [2,4- bis(1,1,1,3,3,3- hexafluoro- 2- hydroxypropan- 2- yl)phenyl]- N- methylfuran- 2- carboxamide
Smiles: CN(c1ccc(cc1C(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O)C(=O)c1ccco1

STK834019
Synonyms: (2Z)- 3- [(4- ethylphenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)CC)/c1scc(n1)c1cccc(c1)OC

STK527790
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527791
Synonyms: 7- methoxy- 2- phenylimidazo[2,1- b][1,3]benzothiazole
Smiles: COc1ccc2c(c1)sc1n2cc(n1)c1ccccc1

STK527792
Synonyms: 2- (4- bromophenyl)- 1- [3- (pyrrolidin- 1- yl)propyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1CCCN1CCCC1)nc1c2cccc1

STK527795
Synonyms: 2- amino- 5- oxo- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydro- 4H- chromene- 3- carbothioamide
Smiles: NC(=S)C1=C(N)OC2=C(C1c1cccs1)C(=O)CCC2

STK527797
Synonyms: (2Z)- 3- [(2,5- dichlorophenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1Cl)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK527801
Synonyms: (2E)- 3- [(2- methyl- 4- nitrophenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)CC(C)C

STK527806
Synonyms: (2E)- 3- [(2- ethylphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1ccc(cc1)C

STK527809
Synonyms: (2Z)- 2- [4- (3,4- dimethoxyphenyl)- 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(c(c1)OC)OC

STK834029
Synonyms: (2E)- 3- [(4- ethoxyphenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1cccc(c1)OC)\C#N

STK527811
Synonyms: dimethyl1- [2- (3,4- dimethoxyphenyl)ethyl]- 2,5- dimethyl- 1H- pyrrole- 3,4- dicarboxylate
Smiles: COC(=O)c1c(C(=O)OC)c(n(c1C)CCc1ccc(c(c1)OC)OC)C

STK527812
Synonyms: 1- [(4- bromophenyl)amino]- 3- (3,6- dibromo- 9H- carbazol- 9- yl)propan- 2- ol
Smiles: Brc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK527818
Synonyms: (2Z)- 3- (4- butoxyphenyl)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)/C=C(\c1scc(n1)c1ccc(c(c1)OC)OC)/C#N

STK527822
Synonyms: N- cyclohexyl- 2- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1Cl)c1nc(NC2CCCCC2)c2c(n1)cccc2

STK527823
Synonyms: 2- chloro- N- (5,6- diphenyl- 1,2,4- triazin- 3- yl)acetamide
Smiles: ClCC(=O)Nc1nnc(c(n1)c1ccccc1)c1ccccc1

STK527824
Synonyms: 4,4'- (phenylmethanediyl)bis[3- methyl- 1- (pyridin- 2- yl)- 1H- pyrazol- 5- ol]
Smiles: Cc1nn(c(c1C(c1c(C)nn(c1O)c1ccccn1)c1ccccc1)O)c1ccccn1

STK527826
Synonyms: 1- [(2E)- 1- (1,1- dioxido- 1,2- benzothiazol- 3- yl)- 2- (4- methoxybenzylidene)hydrazinyl]propan- 2- ol
Smiles: COc1ccc(cc1)/C=N/N(C1=NS(=O)(=O)c2c1cccc2)CC(O)C

STK834036
Synonyms: (2E)- 3- [(2,4- dimethylphenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)C)/c1scc(n1)c1ccccc1

STK527829
Synonyms: (2Z)- 3- [(2,3- dimethylphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834039
Synonyms: (2E)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(4- butoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)c1ccccc1)\C#N

STK527831
Synonyms: (2E)- 3- [(3- bromophenyl)amino]- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK834040
Synonyms: 7- methyl- 2- oxo- 5- phenyl- 2,3- dihydro- 1H- 1,4- benzodiazepin- 3- ylacetate
Smiles: CC(=O)OC1N=C(c2ccccc2)c2c(NC1=O)ccc(c2)C

STK527834
Synonyms: 2- butyl- 10- iminotetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: CCCCC1OC23CCCCC3C(C1(C#N)C(=N)O2)(C#N)C#N

STK527835
Synonyms: (2E)- 3- [(4- butoxyphenyl)amino]- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)OCC)\C#N

STK834041
Synonyms: N- [4- ({(E)- 2- cyano- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)phenyl]acetamide
Smiles: N#C/C(=C\Nc1ccc(cc1)NC(=O)C)/c1scc(n1)c1ccc(c(c1)C)C

STK527838
Synonyms: (2E)- 3- [(3- bromophenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1ccc(cc1)CC(C)C

STK527841
Synonyms: (2E)- 3- [(3- butoxyphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1cc2ccccc2oc1=O)\C#N

STK527843
Synonyms: 3- {[(1E,2Z)- 2- benzylideneheptylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCCCC/C(=C/c1ccccc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK527844
Synonyms: 2- (2- fluoro- 4- methoxyphenyl)quinoline- 4- carboxylicacid
Smiles: COc1ccc(c(c1)F)c1nc2ccccc2c(c1)C(=O)O

STK527845
Synonyms: (1E)- 1- (2- oxodihydrofuran- 3(2H)- ylidene)ethyltricyclo[3.3.1.1~3,7~]decane- 1- carboxylate
Smiles: C/C(=C\1/CCOC1=O)/OC(=O)C12CC3CC(C2)CC(C1)C3

STK527851
Synonyms: 7- (3- bromobenzyl)- 3- methyl- 8- [(2E)- 2- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1cccc(c1)Cn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C

STK527852
Synonyms: N- {(E)- amino[(4,6,7- trimethylquinazolin- 2- yl)amino]methylidene}- 2- methylpropanamide
Smiles: N/C(=N\C(=O)C(C)C)/Nc1nc(C)c2c(n1)cc(c(c2)C)C

STK527853
Synonyms: ethyl1- [2- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)- 2- oxoethyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)c1c(C)n(c2c1cc(OC)cc2)C

STK834045
Synonyms: (2Z,4E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 5- phenylpenta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccccc1)/c1scc(n1)c1ccc2c(c1)OCO2

STK527854
Synonyms: 8- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 4- phenylquinoline
Smiles: Cc1ccc(n1c1cccc2c1nccc2c1ccccc1)C

STK527856
Synonyms: 1- [4,6- bis(ethylamino)- 1,3,5- triazin- 2- yl]- 1- ethylthiourea
Smiles: CCNc1nc(NCC)nc(n1)N(C(=S)N)CC

STK527858
Synonyms: 4- chloro- N- [4- (5- {[(4- chlorophenyl)carbonyl]amino}- 1H- benzimidazol- 2- yl)phenyl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc(cc1)c1[nH]c2c(n1)cc(cc2)NC(=O)c1ccc(cc1)Cl

STK527861
Synonyms: [(3- methyl- 2,6- dioxo- 7- propyl- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]aceticacid
Smiles: CCCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK834048
Synonyms: 3,3'- [(3- fluorophenyl)methanediyl]bis(4- hydroxy- 2H- chromen- 2- one)
Smiles: Fc1cccc(c1)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2

STK834053
Synonyms: 3,3'- [benzene- 1,4- diylbis(oxy)]bis{1- [(4- methylphenyl)amino]propan- 2- ol}
Smiles: OC(COc1ccc(cc1)OCC(CNc1ccc(cc1)C)O)CNc1ccc(cc1)C

STK527874
Synonyms: (2Z)- 3- [(3,5- 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/Nc1cc(C)cc(c1)C)/c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK834054
Synonyms: 2,2'- (1H- 1,2,4- triazole- 3,5- diyl)diphenol
Smiles: Oc1ccccc1c1n[nH]c(n1)c1ccccc1O

STK527878
Synonyms: 6- amino- 3- methyl- 4- [5- (4- nitrophenyl)furan- 2- yl]- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])c(C)n[nH]2

STK527880
Synonyms: 4- [4- (2,3- dimethylphenyl)piperazin- 1- yl]- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cccc(c1C)C

STK527883
Synonyms: 10- nonylacridin- 9(10H)- one
Smiles: CCCCCCCCCn1c2ccccc2c(=O)c2c1cccc2

STK527886
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- N- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2nnc(s2)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527887
Synonyms: N- {2- [2- (4- methoxyphenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]ethyl}- 2- methylpropan- 2- amine
Smiles: COc1ccc(cc1)c1cn2c(n1CCNC(C)(C)C)nc1c2cccc1

STK527891
Synonyms: furan- 2- yl{4- [6- (naphthalen- 1- yloxy)hexyl]piperazin- 1- yl}methanone
Smiles: O=C(c1ccco1)N1CCN(CC1)CCCCCCOc1cccc2c1cccc2

STK527894
Synonyms: N- {(E)- 2- [bis(propan- 2- yloxy)phosphoryl]- 2- chloroethenyl}glycine
Smiles: CC(OP(=O)(/C(=C\NCC(=O)O)/Cl)OC(C)C)C

STK527896
Synonyms: ethyl3,3,3- trifluoro- N- (pyridin- 3- ylcarbonyl)- 2- [(pyridin- 2- ylmethyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)NCc1ccccn1

STK834067
Synonyms: (2Z)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- (phenylamino)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1)/c1scc(n1)c1ccc(cc1)Cl

STK834070
Synonyms: (2E)- 3- [(4- ethoxyphenyl)amino]- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)OC)\C#N

STK834071
Synonyms: (4R)- 5- acetyl- 6- methyl- 4- (2- nitrophenyl)- 2- {[2- oxo- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]sulfanyl}- 1,4- dihydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCC(=O)C23CC4CC(C3)CC(C2)C4)NC(=C([C@H]1c1ccccc1[N+](=O)[O-])C(=O)C)C

STK527911
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 1- (1H- indol- 3- yl)ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCN(CC1)Cc1ccccc1

STK834074
Synonyms: 8- (ethylamino)- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(NCC)nc2c1c(=O)[nH]c(=O)n2C

STK527914
Synonyms: (5E)- 1- methyl- 5- [1- (phenylamino)ethylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)NC(=O)/C(=C(\Nc2ccccc2)/C)/C1=O

STK834076
Synonyms: N'- [(E)- furan- 2- ylmethylidene]- 3- (2- oxopyrrolidin- 1- yl)benzohydrazide
Smiles: O=C1CCCN1c1cccc(c1)C(=O)N/N=C/c1ccco1

STK834077
Synonyms: 3- (3- nitrophenyl)- 3,4- dihydro- 2H- benzo[f]chromeno[3,4- c]quinolin- 2- one
Smiles: O=c1oc2ccccc2c2c1C(Nc1c2c2ccccc2cc1)c1cccc(c1)[N+](=O)[O-]

STK527920
Synonyms: (2E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1c(C)cc(cc1C)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527924
Synonyms: N'- [(3E)- 5- bromo- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]- 4- methoxybenzohydrazide
Smiles: COc1ccc(cc1)C(=O)N/N=C/1\c2cc(Br)ccc2N(C1=O)CN1CCCCC1c1cccnc1

STK527928
Synonyms: ethyl2- (piperidin- 1- yl)- 6- (pyridin- 3- yl)- 4- (trifluoromethyl)- 4H- 1,3,5- oxadiazine- 4- carboxylate
Smiles: CCOC(=O)C1(N=C(OC(=N1)c1cccnc1)N1CCCCC1)C(F)(F)F

STK527930
Synonyms: 4- (furan- 2- yl)- 6- methyl- 2- sulfanylpyridine- 3- carbonitrile
Smiles: N#Cc1c(S)nc(cc1c1ccco1)C

STK527933
Synonyms: methyl1- (3,4- dimethoxyphenyl)- 2- methyl- 5- phenyl- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1cc(n(c1C)c1ccc(c(c1)OC)OC)c1ccccc1

STK834084
Synonyms: 7- hexyl- 3- methyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1

STK834085
Synonyms: 8- (ethylsulfanyl)- 3- methyl- 7- (3- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C

STK527935
Synonyms: (7E)- N- hydroxy- 4,4,6,6- tetramethyl- 5- nitroso- 5,6- dihydro[1,2,5]oxadiazolo[3,4- c]pyridin- 7(4H)- imine
Smiles: O=NN1C(C)(C)/C(=N\O)/c2c(C1(C)C)non2

STK527938
Synonyms: 1- (8- methyl- 5H- pyrimido[5,4- b]indol- 4- yl)- 4- [3- (trifluoromethyl)phenyl]piperidin- 4- ol
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCC(CC1)(O)c1cccc(c1)C(F)(F)F

STK527942
Synonyms: 3- (3- hydroxypropyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: OCCCn1cnc2c(c1=O)[nH]c1c2cccc1

STK834093
Synonyms: 8- (azepan- 1- yl)- 7- benzyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(Cc1ccccc1)c(n2)N1CCCCCC1)C

STK527947
Synonyms: 2- [(1,1- dioxido- 2,5- dihydrothiophen- 3- yl)methyl]- 1H- 2lambda~4~,1,3- benzothiadiazole
Smiles: O=S1(=O)CC=C(C1)CS1=Nc2c(N1)cccc2

STK834094
Synonyms: (2Z)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1C)/c1scc(n1)c1ccc(cc1)Cl

STK527948
Synonyms: 5- [(E)- (3,5- dimethyl- 1,2- oxazol- 4- yl)diazenyl]- 2,1,3- benzoxadiazol- 4- amine
Smiles: Cc1onc(c1/N=N/c1ccc2c(c1N)non2)C

STK527950
Synonyms: 4- [2- amino- 3- cyano- 6- methyl- 4,4- bis(trifluoromethyl)pyridin- 1(4H)- yl]- N- (2,6- dimethylpyrimidin- 4- yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2cc(C)nc(n2)C)C(=CC1(C(F)(F)F)C(F)(F)F)C

STK834095
Synonyms: (2Z)- 3- [(2,3- dichlorophenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1cccc(c1)OC

STK527955
Synonyms: (2E)- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1c(C)cc(cc1C)C)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK527959
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 1- ylamino)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1cccc2)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527961
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(pyridin- 2- ylmethyl)amino]propan- 2- yl}furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC(C(F)(F)F)(C(F)(F)F)NCc1ccccn1

STK527964
Synonyms: 2- (4- propoxybenzyl)butanedioicacid
Smiles: CCCOc1ccc(cc1)CC(C(=O)O)CC(=O)O

STK527965
Synonyms: 3- [3- (4- chlorophenyl)benzo[f]quinolin- 1- yl]- 2H- chromen- 2- one
Smiles: Clc1ccc(cc1)c1nc2ccc3c(c2c(c1)c1cc2ccccc2oc1=O)cccc3

STK527967
Synonyms: (2Z)- 3- [(3- methylphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK527969
Synonyms: (1Z,4E)- N,N'- dihydroxy- 2- methyl- 5- (propan- 2- yl)cyclohexa- 2,5- diene- 1,4- diimine
Smiles: O/N=C\1/C=C(C(C)C)/C(=N/O)/C=C1C

STK527970
Synonyms: N- [(E)- {4- methoxy- 3- [(pyridin- 2- yloxy)methyl]phenyl}methylidene]- 1H- 1,2,4- triazol- 5- amine
Smiles: COc1ccc(cc1COc1ccccn1)/C=N/c1ncn[nH]1

STK527971
Synonyms: 1,4- bis(oxiran- 2- ylmethyl)- 1,4- dihydro- 5H- tetrazol- 5- one
Smiles: O=c1n(CC2OC2)nnn1CC1OC1

STK527972
Synonyms: (2Z)- 3- (3- bromophenyl)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1cccc(c1)Br)/c1scc(n1)c1ccc(c(c1)OC)OC

STK527973
Synonyms: 2- imino- 10- propyltetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: CCCC1OC23CCCCC3C(C1(C#N)C(=N)O2)(C#N)C#N

STK527974
Synonyms: ethyl1- (3,4- dimethoxybenzyl)- 2,4,5- trimethyl- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c(c1C)C)Cc1ccc(c(c1)OC)OC

STK527975
Synonyms: methyl1- benzyl- 5- bromo- 6- oxo- 1,6- dihydropyridine- 3- carboxylate
Smiles: COC(=O)c1cn(Cc2ccccc2)c(=O)c(c1)Br

STK527977
Synonyms: N- (2- {(2E)- 2- [4- methoxy- 3- (morpholin- 4- ylmethyl)benzylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: COc1ccc(cc1CN1CCOCC1)/C=N/NC(=O)CNC(=O)c1ccccc1

STK527978
Synonyms: 1- methyl- 5- (naphthalen- 2- yloxy)- 4- nitro- 1H- imidazole
Smiles: Cn1cnc(c1Oc1ccc2c(c1)cccc2)[N+](=O)[O-]

STK834106
Synonyms: (2E)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)C)C)/c1scc(n1)c1ccc(c(c1)OC)OC

STK527981
Synonyms: 9- methyl- 10- [2- (trifluoromethyl)benzyl]decahydroacridine- 4a,10a(2H,10H)- dicarbonitrile
Smiles: N#CC12CCCCC1C(C)C1C(N2Cc2ccccc2C(F)(F)F)(C#N)CCCC1

STK527982
Synonyms: (2Z)- 3- [(2,3- dichlorophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc(cc1)C

STK527984
Synonyms: N- [(E)- {4- methoxy- 3- [(pyridin- 2- ylsulfanyl)methyl]phenyl}methylidene]morpholin- 4- amine
Smiles: COc1ccc(cc1CSc1ccccn1)/C=N/N1CCOCC1

STK527986
Synonyms: (2E)- 3- [(4- iodophenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)I)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK527989
Synonyms: ethyl{10- [N- (tricyclo[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(C3)CC(C1)C4)c1c(S2)cccc1

STK527991
Synonyms: methyl2- (4- {[({[(1E)- 1- chloropropylidene]amino}oxy)carbonyl](methyl)amino}phenyl)- 3,3,3- trifluoro- 2- hydroxypropanoate
Smiles: CC/C(=N\OC(=O)N(c1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O)C)/Cl

STK834114
Synonyms: diethyl[1- (phenylamino)cyclohexyl]phosphonate
Smiles: CCOP(=O)(C1(CCCCC1)Nc1ccccc1)OCC

STK527994
Synonyms: (2E)- 3- [(4- chlorophenyl)amino]- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Cl)/c1scc(n1)c1ccc(cc1)Cl

STK527995
Synonyms: (2Z)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(cc1)Br

STK528000
Synonyms: 1,1''- dichloro- 1,1':3',1''- ter(cyclohexan)- 2'- one
Smiles: O=C1C(CCCC1C1(Cl)CCCCC1)C1(Cl)CCCCC1

STK528003
Synonyms: 2- (4- chlorophenyl)- 1- (cyclopropylcarbonyl)- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)C(c2ccc(cc2)Cl)C(N2C1C=Cc1c2cccc1)C(=O)C1CC1

STK528004
Synonyms: 2- {(E)- [(6- methylpyridin- 2- yl)imino]methyl}- 4- nitronaphthalen- 1- ol
Smiles: Cc1cccc(n1)/N=C/c1cc([N+](=O)[O-])c2c(c1O)cccc2

STK834118
Synonyms: 5- cyano- 4- (furan- 2- yl)- 2- methyl- 6- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK528005
Synonyms: (2Z)- 2- {[4- (dimethylamino)phenyl]imino}- 6- methoxybenzo[de]chromen- 3(2H)- one
Smiles: COc1ccc2c3c1cccc3O/C(=N\c1ccc(cc1)N(C)C)/C2=O

STK528006
Synonyms: 2- (3,4- dichlorophenyl)- N- (propan- 2- yl)quinazolin- 4- amine
Smiles: CC(Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)C

STK834122
Synonyms: N- (3- chlorophenyl)- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)quinoxalin- 2- amine
Smiles: Clc1cccc(c1)Nc1nc2ccccc2nc1n1nc(cc1C)C

STK528010
Synonyms: 2- [(1,3- dioxolan- 2- ylmethyl)(methyl)amino]- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN(CC1OCCO1)C

STK528017
Synonyms: 2- methyl- 6- (4- methylphenyl)imidazo[1,2- b][1,2,4]triazin- 3(4H)- one
Smiles: Cc1ccc(cc1)c1nc2n(c1)nc(c(=O)[nH]2)C

STK528018
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2- chlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK528020
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- N- (pyridin- 4- ylmethyl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccncc2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK528024
Synonyms: N- (4- acetylphenyl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1ccc(cc1)C(=O)C

STK528025
Synonyms: ethyl5- fluoro- 3- ({[(3R)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(C(C1)C)c1cccc(c1)OC)cc(cc2)F

STK528026
Synonyms: (2Z)- 3- [(5- chloro- 2- methoxyphenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1OC)/c1scc(n1)c1ccc(cc1)CC(C)C

STK528028
Synonyms: 3- (3,5- dimethoxybenzyl)- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(cc(c1)OC)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK528030
Synonyms: 1,1- dioxido- 4,5- dihydrothiophen- 3- ylhexylsulfoxide
Smiles: CCCCCCS(=O)C1=CS(=O)(=O)CC1

STK834131
Synonyms: 8- (butan- 2- ylsulfanyl)- 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(SC(CC)C)nc2c1c(=O)[nH]c(=O)n2C

STK834132
Synonyms: (2Z)- 3- [(3- methylphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK528033
Synonyms: ethylN- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 3,3,3- trifluoro- 2- (propanoylamino)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCC2)NC(=O)CC

STK528044
Synonyms: 5- fluoro- 1- (tetrahydrofuran- 2- yl)pyrimidine- 2,4(1H,3H)- dione
Smiles: O=c1[nH]c(=O)n(cc1F)C1CCCO1

STK528045
Synonyms: (2Z)- 3- [(4- fluorophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(cc1)C

STK834136
Synonyms: 1- (cyclopropylcarbonyl)- 2- (furan- 2- yl)- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)C2C=Cc3c(N2C(C1c1ccco1)C(=O)C1CC1)cccc3

STK528048
Synonyms: 2- methoxy- 6- {(E)- [2- ([1,2,4]triazolo[4,3- a]quinoxalin- 4- yl)hydrazinylidene]methyl}phenol
Smiles: COc1cccc(c1O)/C=N/Nc1nc2ccccc2n2c1nnc2

STK528049
Synonyms: (2Z)- 3- (naphthalen- 1- yl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1cccc2c1cccc2)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528054
Synonyms: 1,1':3',1''- ter(cyclohexane)- 1,1''- dien- 2'- one
Smiles: O=C1C(CCCC1C1=CCCCC1)C1=CCCCC1

STK528060
Synonyms: (2E)- 3- [(3- butoxyphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1ccc(cc1)[N+](=O)[O-])\C#N

STK528062
Synonyms: 2,2'- ethane- 1,2- diylbis[1- (oxiran- 2- ylmethyl)- 1H- benzimidazole]
Smiles: c1ccc2c(c1)n(CC1CO1)c(n2)CCc1nc2c(n1CC1CO1)cccc2

STK834144
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(4- methylphenyl)amino]propan- 2- ol
Smiles: Cc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK834147
Synonyms: 1,7- dibenzyl- 8- [(2- hydroxypropyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CSc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)O

STK834150
Synonyms: N- ethyl- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK834151
Synonyms: 1,3- dibenzyl- 4,6- dimethyl- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: Cc1cc(C)c2c(c1)n(Cc1ccccc1)c(=O)n2Cc1ccccc1

STK528067
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK528068
Synonyms: 4H,8H- benzo[1,2- c:4,5- c']bis[1,2,5]oxadiazole- 4,8- dione
Smiles: O=C1c2nonc2C(=O)c2c1non2

STK528071
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1

STK528078
Synonyms: (2E)- 3- [(4- bromophenyl)amino]- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Br)/c1scc(n1)c1cccc(c1)Br

STK834158
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(4- ethoxyphenyl)amino]propan- 2- ol
Smiles: CCOc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK528080
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK834159
Synonyms: 3- [(4,5- dihydro- 1,3- thiazol- 2- ylsulfanyl)methyl]- 1,3- benzoxazol- 2(3H)- one
Smiles: O=c1oc2c(n1CSC1=NCCS1)cccc2

STK834161
Synonyms: (2E)- 3- [(2- methoxyphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528084
Synonyms: benzo[1,2- d:3,4- d']bis[1,2,3]triazole- 1,6- diol
Smiles: On1nnc2c1ccc1c2n(O)nn1

STK528086
Synonyms: 1,2,5- trimethyl- 4- phenylpiperidin- 4- ylbenzoate
Smiles: CC1CC(OC(=O)c2ccccc2)(C(CN1C)C)c1ccccc1

STK528089
Synonyms: 5- [bis(2,6- dioxo- 4- phenylcyclohexyl)methyl]- 2- methoxybenzylacetate
Smiles: COc1ccc(cc1COC(=O)C)C(C1C(=O)CC(CC1=O)c1ccccc1)C1C(=O)CC(CC1=O)c1ccccc1

STK528090
Synonyms: N- (2- chlorophenyl)- 4,6- dimethoxy- 1,3,5- triazin- 2- amine
Smiles: COc1nc(nc(n1)OC)Nc1ccccc1Cl

STK528094
Synonyms: 1,1- dioxido- 2,3- dihydrothiophen- 3- ylhexylsulfoxide
Smiles: CCCCCCS(=O)C1C=CS(=O)(=O)C1

STK528098
Synonyms: 8- methyl- 4- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK528099
Synonyms: (2E)- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1c(C)cc(cc1C)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK528100
Synonyms: methyl3- methyl- 6- (morpholin- 4- yl)- 1- phenyl- 4- (trifluoromethyl)- 1,4- dihydropyrazolo[4,3- e][1,3]oxazine- 4- carboxylate
Smiles: COC(=O)C1(N=C(Oc2c1c(C)nn2c1ccccc1)N1CCOCC1)C(F)(F)F

STK834167
Synonyms: 2,2'- (1,2,4- thiadiazole- 3,5- diyldisulfanediyl)bis[N- (3- chlorophenyl)acetamide]
Smiles: O=C(Nc1cccc(c1)Cl)CSc1snc(n1)SCC(=O)Nc1cccc(c1)Cl

STK528102
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- chlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Cl)/c1scc(n1)c1cccc(c1)Br

STK528103
Synonyms: 2- (5'- formyl- 2,2'- bithiophen- 5- yl)quinoline- 4- carboxylicacid
Smiles: O=Cc1ccc(s1)c1ccc(s1)c1nc2ccccc2c(c1)C(=O)O

STK834170
Synonyms: 2,2,3,3,4,4,4- heptafluoro- N- (2- methyl- 1,3- dioxo- 2,3- dihydro- 1H- isoindol- 5- yl)butanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1ccc2c(c1)C(=O)N(C2=O)C

STK528106
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)cccc2)NCc1ccc2c(c1)OCO2

STK528107
Synonyms: methyl3- ({[4- (2,3- dimethylphenyl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cc(cc2)C

STK528108
Synonyms: (2Z)- 3- [(2,5- dichlorophenyl)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(Cl)ccc1Cl)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK528110
Synonyms: 4- [4- (diphenylmethyl)piperazin- 1- yl]- 5H- pyrimido[5,4- b]indole
Smiles: c1ccc(cc1)C(c1ccccc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK834173
Synonyms: (2E)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(c(c1)OC)OC

STK834174
Synonyms: 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCC1)COC(C)C

STK528112
Synonyms: N- dodecyl- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK528113
Synonyms: 2- (dimethylamino)- 3- [methyl(nitroso)amino]naphthalene- 1,4- dione
Smiles: O=NN(C1=C(N(C)C)C(=O)c2c(C1=O)cccc2)C

STK528116
Synonyms: N- [1- (2- methylbenzyl)- 1H- benzimidazol- 2- yl]acetamide
Smiles: CC(=O)Nc1nc2c(n1Cc1ccccc1C)cccc2

STK528118
Synonyms: N- {2- [(3- bromophenyl)(5- methylfuran- 2- yl)methyl]- 4,5- dimethoxyphenyl}acetamide
Smiles: COc1cc(NC(=O)C)c(cc1OC)C(c1ccc(o1)C)c1cccc(c1)Br

STK528119
Synonyms: 3- (diethylamino)propyldiphenylacetate
Smiles: CCN(CCCOC(=O)C(c1ccccc1)c1ccccc1)CC

STK834176
Synonyms: (2E)- 3- [(2- ethoxyphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccccc1N/C=C(/c1scc(n1)c1ccc(cc1)[N+](=O)[O-])\C#N

STK528122
Synonyms: methyl3- [(azepan- 1- ylacetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCCC1)cccc2

STK528126
Synonyms: 1- (diphenylmethyl)- 4- [2- (4- fluorophenoxy)ethyl]piperazine
Smiles: Fc1ccc(cc1)OCCN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK834179
Synonyms: 3- benzyl- 7- {[(2Z)- 2- (hydroxyimino)- 2- (4- methylphenyl)ethyl]oxy}- 4,8- dimethyl- 2H- chromen- 2- one
Smiles: O/N=C(/c1ccc(cc1)C)\COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1

STK834180
Synonyms: 4- hydroxy- N- (3- iodophenyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Ic1cccc(c1)NC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK834181
Synonyms: N- [4- ({(E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)phenyl]acetamide
Smiles: N#C/C(=C\Nc1ccc(cc1)NC(=O)C)/c1scc(n1)c1ccc2c(c1)OCO2

STK834182
Synonyms: 2- (2,2- dimethyltetrahydro- 2H- thiopyran- 4- yl)- 4- (4- methoxyphenyl)- 1,3- thiazole
Smiles: COc1ccc(cc1)c1csc(n1)C1CCSC(C1)(C)C

STK528133
Synonyms: 7- benzyl- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK528134
Synonyms: 5- [2- ethoxy- 5- (piperidin- 1- 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)N1CCCCC1)C

STK834185
Synonyms: (5E)- 5- (furan- 2- ylmethylidene)- 1- (4- methoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O

STK834186
Synonyms: (2E)- 3- [(2- ethoxyphenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccccc1N/C=C(/c1scc(n1)c1ccc(cc1)F)\C#N

STK834187
Synonyms: dimethyl{[(2,5- dimethylphenyl)amino](phenyl)methyl}phosphonate
Smiles: COP(=O)(C(c1ccccc1)Nc1cc(C)ccc1C)OC

STK528141
Synonyms: N- cyclohexyl- 2- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(NC2CCCCC2)c2c(n1)cccc2

STK834192
Synonyms: 3- [(2- chlorophenyl)carbonyl]- 2- methyl- 4H- chromen- 4- one
Smiles: Clc1ccccc1C(=O)c1c(C)oc2c(c1=O)cccc2

STK528143
Synonyms: 4- {[(4E)- 1- (4- chlorophenyl)- 5- (4- methoxyphenyl)- 3- oxopent- 4- en- 1- yl]amino}benzoicacid
Smiles: COc1ccc(cc1)/C=C/C(=O)CC(c1ccc(cc1)Cl)Nc1ccc(cc1)C(=O)O

STK528145
Synonyms: (2Z)- 3- [(2,3- dimethylphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK834195
Synonyms: ethyl6- hydroxy- 7- methyl- 6H- [1,2,5]oxadiazolo[3,4- e]indole- 8- carboxylate3- oxide
Smiles: CCOC(=O)c1c(C)n(c2c1c1no[n+](c1cc2)[O-])O

STK528147
Synonyms: (2E)- 1- (2,4- dimethoxyphenyl)- 3- [4- (dimethylamino)phenyl]prop- 2- en- 1- one
Smiles: COc1ccc(c(c1)OC)C(=O)/C=C/c1ccc(cc1)N(C)C

STK528148
Synonyms: (2Z)- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK834196
Synonyms: [3- amino- 4- (5- methylfuran- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl](4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK528149
Synonyms: 2- hydroxy- N'- [(E)- (3- phenyl- 1H- pyrazol- 4- yl)methylidene]benzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/c1c[nH]nc1c1ccccc1

STK528150
Synonyms: 1- cyclohexyl- 3- [(1S,2R)- 2- phenylcyclopropyl]urea
Smiles: O=C(NC1CCCCC1)N[C@H]1C[C@@H]1c1ccccc1

STK528151
Synonyms: (2E)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(cc1)OC

STK528161
Synonyms: 8- (ethylsulfanyl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCC)nc2c1c(=O)[nH]c(=O)n2C

STK528162
Synonyms: (2Z)- 3- (4- bromophenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)Br)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528163
Synonyms: N- [2- (dimethylamino)ethyl]- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3)C

STK528165
Synonyms: 2- (1H- benzimidazol- 2- yl)- N- (4- fluorophenyl)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1)F)NNc1nc2c([nH]1)cccc2

STK528167
Synonyms: 4,6- dimethyl- 5- (morpholin- 4- ylcarbonyl)- 2H- pyran- 2- one
Smiles: O=c1cc(C)c(c(o1)C)C(=O)N1CCOCC1

STK528169
Synonyms: 3- ({7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)propanoicacid
Smiles: OC(Cn1c(SCCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl

STK528171
Synonyms: bis(2- ethoxyethyl)9,10- dihydro- 9,10- ethanoanthracene- 11,12- dicarboxylate
Smiles: CCOCCOC(=O)C1C(C(=O)OCCOCC)C2c3c(C1c1c2cccc1)cccc3

STK834202
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1ccc2c(c1)OCO2

STK528174
Synonyms: [(2E)- 2- {(2Z)- [1- (4- butoxyphenyl)ethylidene]hydrazinylidene}- 4- oxo- 1,3- thiazolidin- 5- yl]aceticacid
Smiles: CCCCOc1ccc(cc1)/C(=N\N=C\1/NC(=O)C(S1)CC(=O)O)/C

STK834203
Synonyms: 2- (4- methylphenyl)- 5- (morpholin- 4- yl)- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1N1CCOCC1)c1ccc(cc1)C

STK528178
Synonyms: methyl3- ({[3- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK834205
Synonyms: 7- phenyl- 4,5- dihydro- 6H- imidazo[4,5- e][2,1,3]benzoxadiazol- 6- ol
Smiles: On1c(nc2c1CCc1c2non1)c1ccccc1

STK834207
Synonyms: N'- (2- hydroxy- 2- propylpentanoyl)- 5- methyl- N- phenylthiophene- 3- carbohydrazide
Smiles: CCCC(C(=O)NN(C(=O)c1csc(c1)C)c1ccccc1)(CCC)O

STK528180
Synonyms: 4- {[(1E)- 3- (2,4- dimethoxyphenyl)- 3- oxoprop- 1- en- 1- yl]amino}- N- (2,6- dimethoxypyrimidin- 4- yl)benzenesulfonamide
Smiles: COc1ccc(c(c1)OC)C(=O)/C=C/Nc1ccc(cc1)S(=O)(=O)Nc1cc(OC)nc(n1)OC

STK528187
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccccc1

STK528188
Synonyms: (2Z)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- (3- methoxyphenyl)prop- 2- enenitrile
Smiles: COc1cccc(c1)/C=C(\c1scc(n1)c1ccc(c(c1)OC)OC)/C#N

STK528189
Synonyms: 1- (2- methoxyphenyl)- 4- [4- (naphthalen- 1- yloxy)butyl]piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCOc1cccc2c1cccc2

STK834210
Synonyms: 8- (butylsulfanyl)- 3- methyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCSc1nc2c(n1C(C)C)c(=O)[nH]c(=O)n2C

STK528192
Synonyms: 8- bromo- 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK834213
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)Cn1nc(cc1C)C

STK528195
Synonyms: (2E)- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)C)C)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK834214
Synonyms: (2E)- 3- [(2- iodophenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK834215
Synonyms: N- [(1E)- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 1- (2- methoxyphenyl)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: COc1ccccc1/C=C(\C(=O)NCCc1c[nH]c2c1cccc2)/NC(=O)c1ccccc1

STK834216
Synonyms: (2E)- 3- [(3,5- dimethylphenyl)amino]- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1cc(C)cc(c1)C)/C#N

STK528196
Synonyms: 6,7- dimethoxy- 3- (quinolin- 6- ylamino)- 2- benzofuran- 1(3H)- one
Smiles: COc1ccc2c(c1OC)C(=O)OC2Nc1ccc2c(c1)cccn2

STK528198
Synonyms: 3- (1- methyl- 5- oxo- 2- thioxoimidazolidin- 4- yl)propanoicacid
Smiles: CN1C(=O)C(NC1=S)CCC(=O)O

STK528199
Synonyms: 4- ({3- [(3- methylbutyl)amino]- 3- oxopropanoyl}amino)benzoicacid
Smiles: CC(CCNC(=O)CC(=O)Nc1ccc(cc1)C(=O)O)C

STK528204
Synonyms: N- ({2- [(2E)- 2- cyano- 3- (4- methoxyphenyl)prop- 2- enoyl]hydrazinyl}carbonothioyl)- 3- methylbenzamide
Smiles: N#C/C(=C\c1ccc(cc1)OC)/C(=O)NNC(=S)NC(=O)c1cccc(c1)C

STK834219
Synonyms: N- (pyridin- 2- ylmethyl)- 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)NCc1ccccn1

STK528205
Synonyms: N- [2- (diethylamino)ethyl]- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CCN(CCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3)CC

STK528206
Synonyms: 6- {2- [(3- bromobenzyl)amino]phenoxy}- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: Brc1cccc(c1)CNc1ccccc1Oc1cc(=O)n(c(=O)n1C)C

STK834223
Synonyms: 1- ethyl- N- (2- fluorophenyl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCn1c(=O)c(C(=O)Nc2ccccc2F)c(c2c1cccc2)O

STK528214
Synonyms: 2- [(Z)- {[(1E)- 1- (hydroxyimino)- 2- methylpropan- 2- yl](oxido)- lambda~5~- azanylidene}methyl]- 4,5- dimethyl- 1H- imidazol- 1- ol
Smiles: O/N=C/C(/[N+](=C/c1nc(c(n1O)C)C)/[O-])(C)C

STK528221
Synonyms: (2E)- 3- (3,5- dibromo- 2- hydroxyphenyl)- 1- (5- methylfuran- 2- yl)prop- 2- en- 1- one
Smiles: Cc1ccc(o1)C(=O)/C=C/c1cc(Br)cc(c1O)Br

STK528222
Synonyms: methyl4- {[(4- chlorophenyl)(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)methyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(c1c(=O)n(n(c1C)C)c1ccccc1)c1ccc(cc1)Cl

STK834227
Synonyms: N- (3,4- difluorophenyl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)cccc2)Nc1ccc(c(c1)F)F

STK528227
Synonyms: (2Z)- 3- [(4- fluorophenyl)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)F)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834231
Synonyms: (2Z)- 3- (3- bromophenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1cccc(c1)Br)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528234
Synonyms: 5- [(E)- (2- carbamoylhydrazinylidene)methyl]- 2- oxo- 4- (pyridinium- 1- yl)- 1,3- thiazol- 3- ide
Smiles: NC(=O)N/N=C/c1sc(=O)[n-]c1[n+]1ccccc1

STK834235
Synonyms: (2E)- 3- [(4- methoxyphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)OC)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528237
Synonyms: 4- ethoxy- N- (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)NCCO)C

STK834238
Synonyms: 8- (benzylamino)- 7- hexyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK528241
Synonyms: (2E)- 2- [4- (3- 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)c1cccc(c1)Br

STK528244
Synonyms: (2Z)- 3- (4- methoxy- 3- nitrophenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])OC)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK834242
Synonyms: 6',7'- dihydro- 4,4'- bi- 2,1,3- benzoxadiazol- 7- amine
Smiles: Nc1ccc(c2c1non2)C1=CCCc2c1non2

STK834243
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- fluorophenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1cccc(c1)F)/C#N

STK528246
Synonyms: diethyl{[4,6- bis(dimethylamino)- 1,3,5- triazin- 2- yl](cyano)amino}propanedioate
Smiles: CCOC(=O)C(N(c1nc(nc(n1)N(C)C)N(C)C)C#N)C(=O)OCC

STK528249
Synonyms: 2- cyano- 1- methyl- 3- (2- {[(5- methyl- 1H- imidazol- 4- yl)methyl]sulfanyl}ethyl)guanidine
Smiles: N#C/N=C(\NCCSCc1nc[nH]c1C)/NC

STK834246
Synonyms: (2E)- 3- [(4- bromophenyl)amino]- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Br)/c1scc(n1)c1ccc(c(c1)OC)OC

STK528250
Synonyms: (2Z)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,5- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1C)/c1scc(n1)c1ccc(cc1)Br

STK528251
Synonyms: ethyl3- ({[4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]acetyl}amino)- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccc3c(c1)OCO3)cc(cc2)F

STK528252
Synonyms: (2E)- 3- [(4- ethoxyphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1cccc(c1)[N+](=O)[O-])\C#N

STK834247
Synonyms: 3- (2- hydroxyphenyl)- 5- (1,1,2,2- tetrafluoroethyl)- 4,5- dihydro- 1,2- oxazol- 5- ol
Smiles: FC(C(C1(O)ON=C(C1)c1ccccc1O)(F)F)F

STK528253
Synonyms: ethyl6,7- dimethyl- 2,4- bis(trifluoromethyl)- 3,4- dihydroquinazoline- 4- carboxylate
Smiles: CCOC(=O)C1(NC(=Nc2c1cc(C)c(c2)C)C(F)(F)F)C(F)(F)F

STK528254
Synonyms: bis[2- (morpholin- 4- yl)ethyl]nonanedioate
Smiles: O=C(OCCN1CCOCC1)CCCCCCCC(=O)OCCN1CCOCC1

STK528260
Synonyms: 2- ethyl- 3- methyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCc1nc2c3ccccc3CC3(c2c(=O)n1C)CCCCC3

STK834249
Synonyms: (2Z)- 3- (4- butoxyphenyl)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)/C=C(\c1scc(n1)c1ccc(cc1Cl)Cl)/C#N

STK528263
Synonyms: 6a- (morpholin- 4- yl)- 4,5,6a,7,8,9,10,10a- octahydro- 10bH- [1,2,5]oxadiazolo[3,4- c]carbazol- 10b- ol6- oxide
Smiles: [O-][N+]1=C2CCc3c(C2(C2C1(CCCC2)N1CCOCC1)O)non3

STK834251
Synonyms: (2E)- 3- [(4- methylphenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK834253
Synonyms: (2Z)- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}- 3- (phenylamino)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1)/c1scc(n1)c1ccc(cc1)CC(C)C

STK528268
Synonyms: 4- {[(dipropoxyphosphoryl)(phenyl)methyl]amino}benzoicacid
Smiles: CCCOP(=O)(C(c1ccccc1)Nc1ccc(cc1)C(=O)O)OCCC

STK528272
Synonyms: 6- amino- 3- methyl- 4- (2- methylpropyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1CC(C)C)c(C)n[nH]2

STK528278
Synonyms: 7- (3- bromobenzyl)- 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK834259
Synonyms: (2Z)- 3- [(3,5- dichlorophenyl)amino]- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)cc(c1)Cl)/c1scc(n1)c1ccc(c(c1)OC)OC

STK528281
Synonyms: 2- methoxy- 4- {(E)- [2- ([1,2,4]triazolo[4,3- a]quinoxalin- 4- yl)hydrazinylidene]methyl}phenol
Smiles: COc1cc(/C=N/Nc2nc3ccccc3n3c2nnc3)ccc1O

STK834262
Synonyms: 8- {(2E)- 2- [1- (2- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(=O)[nH]c(=O)n2C

STK528284
Synonyms: {[3- methyl- 7- (3- methylbenzyl)- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C

STK834264
Synonyms: ethyl4- {[(E)- (4- nitrophenyl)methylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK834265
Synonyms: 3- chloro- 6- nitro- 9H- carbazole
Smiles: Clc1ccc2c(c1)c1cc(ccc1[nH]2)[N+](=O)[O-]

STK528288
Synonyms: 3- (hexylsulfanyl)- 2,3- dihydrothiophene1,1- dioxide
Smiles: CCCCCCSC1C=CS(=O)(=O)C1

STK528290
Synonyms: (2Z)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1cccc(c1)Br

STK834267
Synonyms: 1- (5- methyl- 1,2- oxazol- 3- yl)- 3- naphthalen- 1- ylurea
Smiles: O=C(Nc1cccc2c1cccc2)Nc1noc(c1)C

STK834268
Synonyms: 2- [3- (3,6- dibromo- 9H- carbazol- 9- yl)- 2- hydroxypropyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CN1C(=O)c2c(C1=O)cccc2

STK528291
Synonyms: 1- methyl[1]benzothieno[2,3- c]pyridin- 3- ol
Smiles: Oc1nc(C)c2c(c1)c1ccccc1s2

STK528297
Synonyms: ethyl1- (4- butoxyphenyl)- 2,4,5- trimethyl- 1H- pyrrole- 3- carboxylate
Smiles: CCCCOc1ccc(cc1)n1c(C)c(c(c1C)C(=O)OCC)C

STK528300
Synonyms: 2- (2,4- dichlorophenyl)- 4- (pyrrolidin- 1- yl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc2ccccc2c(n1)N1CCCC1

STK528305
Synonyms: decyl(2E)- 2- cyano- 3- (5- phenylfuran- 2- yl)prop- 2- enoate
Smiles: CCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccccc1)/C#N

STK528307
Synonyms: 3- (cyanomethyl)- 2,2- dimethylcyclopropanecarbonitrile
Smiles: N#CCC1C(C1(C)C)C#N

STK528308
Synonyms: 7- (2- hydroxy- 3- phenoxypropyl)- 3- methyl- 8- (propylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCSc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C

STK528311
Synonyms: 5- {1- [(4- chlorophenyl)amino]ethylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CC(=C1C(=O)NC(=O)NC1=O)Nc1ccc(cc1)Cl

STK834281
Synonyms: 2- [(7- butyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK528314
Synonyms: 2- {[3- (methylamino)- 3- oxopropanoyl]amino}benzoicacid
Smiles: CNC(=O)CC(=O)Nc1ccccc1C(=O)O

STK528318
Synonyms: methyl{[6- amino- 3,5- dicyano- 4- (propan- 2- yl)pyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(N)c(c(c1C#N)C(C)C)C#N

STK834284
Synonyms: 3,5- diphenyl- 1H- pyrazol- 4- amine
Smiles: Nc1c([nH]nc1c1ccccc1)c1ccccc1

STK528322
Synonyms: 7- ethyl- 8- {4- [2- (1H- indol- 3- yl)- 2- oxoethyl]piperazin- 1- yl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK834285
Synonyms: (5E)- 1- [2- (4- fluorophenyl)ethyl]- 5- (1H- pyrrol- 2- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)CCN1C(=O)NC(=O)/C(=C\c2[nH]ccc2)/C1=O

STK834286
Synonyms: 6- (benzylsulfanyl)- 5- cyano- 4- (furan- 2- yl)- N- (2- methoxyphenyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK528324
Synonyms: 2- {[(4R)- 4- hydroxy- 1,1- dioxidotetrahydrothiophen- 3- yl]amino}butanoicacid
Smiles: CCC(C(=O)O)NC1CS(=O)(=O)C[C@@H]1O

STK834287
Synonyms: 2- (6- methoxypyrimidin- 4- yl)phenol
Smiles: COc1ncnc(c1)c1ccccc1O

STK834289
Synonyms: N- [4- ({(E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)phenyl]acetamide
Smiles: N#C/C(=C\Nc1ccc(cc1)NC(=O)C)/c1scc(n1)c1cccc(c1)Br

STK528326
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1C)/c1scc(n1)c1ccc(cc1Cl)Cl

STK528328
Synonyms: 2- (4- methylphenyl)- 1- [3- (pyrrolidin- 1- yl)propyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: Cc1ccc(cc1)c1cn2c(n1CCCN1CCCC1)nc1c2cccc1

STK528330
Synonyms: (2E)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- {[4- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: CC(c1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)c1ccccc1)\C#N)C

STK528336
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2,3- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK834291
Synonyms: (2Z)- 3- [(2,5- dimethoxyphenyl)amino]- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)ccc1OC)/c1scc(n1)c1ccc(cc1C)C

STK834292
Synonyms: 1,3,4- trimethyl- 3a,6a- diphenyltetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: O=C1NC2(C(N1C)(c1ccccc1)N(C(=O)N2C)C)c1ccccc1

STK834293
Synonyms: (2Z)- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1ccc(c(c1)C)C

STK528339
Synonyms: 4- (4- cyclohexylpiperazin- 1- yl)- 8- methoxy- 5H- pyrimido[5,4- b]indole
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)C1CCCCC1

STK834294
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (2- bromophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1Br)/c1scc(n1)c1ccc2c(c1)OCO2

STK528340
Synonyms: (2E)- 3- [(3- methoxyphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: COc1cccc(c1)N/C=C(/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])\C#N

STK834295
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(3- methoxyphenyl)amino]propan- 2- ol
Smiles: COc1cccc(c1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK528343
Synonyms: (2E)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(cc1)Cl

STK834299
Synonyms: 2- benzyltetrahydro- 1H- isoindole- 1,3,5(2H,4H)- trione
Smiles: O=C1CCC2C(C1)C(=O)N(C2=O)Cc1ccccc1

STK528345
Synonyms: 2',2',7- trimethyl- 2,3,3a,6- tetrahydro- 4H- spiro[1- benzothiophene- 5,5'- [1,3]dioxane]- 4',6'- dione1,1- dioxide
Smiles: CC1=C2C(CC3(C1)C(=O)OC(OC3=O)(C)C)CCS2(=O)=O

STK528348
Synonyms: N- (4- methoxyphenyl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(C)cc(=O)oc1C

STK834303
Synonyms: 5- tert- butyl- 2- (2- methylprop- 2- en- 1- yl)- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CC(=C)CN1N=C(CC1=O)C(C)(C)C

STK834304
Synonyms: 3- methyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1cnc2c1c(=O)[nH]c(=O)n2C

STK528349
Synonyms: (2E)- 3- [(3- nitrophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1cc2ccccc2oc1=O

STK528351
Synonyms: (1- methyl- 5- oxo- 2- thioxoimidazolidin- 4- yl)aceticacid
Smiles: CN1C(=O)C(NC1=S)CC(=O)O

STK834306
Synonyms: 6- (biphenyl- 4- yloxy)- 3- methyl[1,2,4]triazolo[4,3- b]pyridazine
Smiles: Cc1nnc2n1nc(cc2)Oc1ccc(cc1)c1ccccc1

STK528356
Synonyms: piperazine- 1,4- diylbis{[2- (oxiran- 2- ylmethoxy)phenyl]methanone}
Smiles: O=C(c1ccccc1OCC1CO1)N1CCN(CC1)C(=O)c1ccccc1OCC1CO1

STK528357
Synonyms: (2E)- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)C)C

STK528360
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccccc1

STK528361
Synonyms: (2E)- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: CCc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)[N+](=O)[O-])/C#N

STK834315
Synonyms: 1- ethyl- 6,7- dimethoxy- 3- methylisoquinoline- 4- carbonitrile
Smiles: COc1cc2c(cc1OC)c(CC)nc(c2C#N)C

STK834317
Synonyms: 2- ({7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)- N- phenylacetamide
Smiles: C/C=C/Cn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK528367
Synonyms: 3- {[(E)- (2- chlorophenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Clc1ccccc1/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK528368
Synonyms: 3- [2- (piperidin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(CCN2CCCCC2)cnc2c1[nH]c1c2cccc1

STK834319
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 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)c1cc2cc(Br)ccc2oc1=O

STK834321
Synonyms: 2- {3- [4- (diphenylmethyl)piperazin- 1- yl]- 3- oxopropyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)CCN1C(=O)c2c(C1=O)cccc2

STK834322
Synonyms: (5E)- 1- tert- butyl- 5- (1H- pyrrol- 2- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1[nH]ccc1)C(C)(C)C

STK528376
Synonyms: {[(2E)- 3- (4- fluorophenyl)- 2- {[(3,4,5- trimethoxyphenyl)carbonyl]amino}prop- 2- enoyl]amino}(phenyl)aceticacid
Smiles: COc1c(OC)cc(cc1OC)C(=O)N/C(=C/c1ccc(cc1)F)/C(=O)NC(c1ccccc1)C(=O)O

STK834323
Synonyms: 2- (4- chlorophenyl)- 4- (piperidin- 1- yl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N2CCCCC2)c2c(n1)cccc2

STK528377
Synonyms: (2Z)- 3- [(2,5- dichlorophenyl)amino]- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1Cl)/c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK528387
Synonyms: (2Z)- 3- [(3- chloro- 4- methylphenyl)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(c(c1)Cl)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK528389
Synonyms: methyl11- (diethylamino)- 10- hydroxyundecanoate
Smiles: CCN(CC(CCCCCCCCC(=O)OC)O)CC

STK834335
Synonyms: 8- (ethylsulfanyl)- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK528391
Synonyms: (5E)- 1- (4- methoxyphenyl)- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\C=C\c2ccccc2)/C1=O

STK834339
Synonyms: (2Z)- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc(c(c1)C)C

STK528393
Synonyms: 3,3'- [hexane- 1,6- diylbis(oxybenzene- 4,1- diyl)]dipyrrolidine- 2,5- dione
Smiles: O=C1NC(=O)CC1c1ccc(cc1)OCCCCCCOc1ccc(cc1)C1CC(=O)NC1=O

STK528399
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 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)c1ccc2c(c1)OCO2

STK528400
Synonyms: 3- methyl- 8- nitro- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)[N+](=O)[O-]

STK528404
Synonyms: N- (4- methoxyphenyl)- 1- methyl- 1H- [1,2,3]triazolo[4,5- c]pyridin- 4- amine
Smiles: COc1ccc(cc1)Nc1nccc2c1nnn2C

STK528406
Synonyms: ethyl2- ({7- [(2Z)- 3- chlorobut- 2- en- 1- yl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)butanoate
Smiles: CCOC(=O)C(Sc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C)CC

STK528410
Synonyms: (2Z)- 3- [(3,5- dimethylphenyl)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(C)cc(c1)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK528414
Synonyms: N- hydroxy- 2,5- dimethylpiperidin- 4- imine
Smiles: O/N=C\1/CC(C)NCC1C

STK528418
Synonyms: (2Z)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(2,3- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)C)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK834350
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 8- (methylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CSc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C

STK834353
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 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)OC

STK834354
Synonyms: 8- (ethylsulfanyl)- 7- (2- hydroxy- 3- phenoxypropyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C

STK528420
Synonyms: (2E)- 3- [(2- methyl- 4- nitrophenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK834355
Synonyms: 2,2- dimethyl- 5- nitro- 2H- benzimidazole1,3- dioxide
Smiles: [O-][N+](=O)c1ccc2=[N+](C([N+](=c2c1)[O-])(C)C)[O-]

STK834356
Synonyms: (2Z)- 3- [(3,5- dimethylphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(C)cc(c1)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK834357
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1c(C)cc(cc1C)C)/C#N

STK528425
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc(cc1)OC

STK528431
Synonyms: ethyl1,3- dioxo- 3,3a,7,7a- tetrahydro- 4,7- ethano- 2- benzofuran- 4(1H)- carboxylate
Smiles: CCOC(=O)C12CCC(C=C1)C1C2C(=O)OC1=O

STK528433
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1c(C)cc(cc1C)C)/c1scc(n1)c1ccc(cc1)OC

STK528434
Synonyms: 1,6- bis(4- ethoxyphenyl)hexane- 1,6- diol
Smiles: CCOc1ccc(cc1)C(CCCCC(c1ccc(cc1)OCC)O)O

STK528435
Synonyms: (2Z)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1ccc(cc1)OC

STK528438
Synonyms: ethyl4- {[2- (dimethylamino)ethyl]amino}- 2- oxo- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1c(=O)[nH]c2c(c1NCCN(C)C)cccc2

STK528439
Synonyms: N- benzyl- 1- methyl- 4- nitro- 1H- imidazol- 5- amine
Smiles: Cn1cnc(c1NCc1ccccc1)[N+](=O)[O-]

STK528440
Synonyms: 1- {2- [2- (naphthalen- 1- yloxy)ethoxy]ethyl}- 4- [3- (trifluoromethyl)phenyl]piperazine
Smiles: FC(c1cccc(c1)N1CCN(CC1)CCOCCOc1cccc2c1cccc2)(F)F

STK528443
Synonyms:
Smiles: S=C(Nc1ccc(cc1)F)NNC(=O)C1[C@@H]2[C@H]1CCCC2

STK528445
Synonyms: 1- (1H- indol- 3- yl)- 2- (4- phenylpiperazin- 1- yl)ethanol
Smiles: OC(c1c[nH]c2c1cccc2)CN1CCN(CC1)c1ccccc1

STK834361
Synonyms: (2Z)- 3- [(5- chloro- 2- methoxyphenyl)amino]- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1OC)/c1scc(n1)c1ccc(c(c1)OC)OC

STK528449
Synonyms: 1- ethyl- 3- methyl[1]benzothieno[2,3- c]pyridine
Smiles: CCc1nc(C)cc2c1sc1c2cccc1

STK834363
Synonyms: methyl(1,3- dioxo- 2- phenyl- 2,3- dihydro- 1H- inden- 2- yl)acetate
Smiles: COC(=O)CC1(c2ccccc2)C(=O)c2c(C1=O)cccc2

STK528450
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)OC)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK528459
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(5- chloro- 2- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1OC)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK528461
Synonyms: (2Z)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(3,5- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)cc(c1)Cl)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK834372
Synonyms: 4- (4,5- diphenyl- 1H- imidazol- 2- yl)- N,N- dimethylaniline
Smiles: CN(c1ccc(cc1)c1nc(c([nH]1)c1ccccc1)c1ccccc1)C

STK834373
Synonyms: 8- (butan- 2- ylsulfanyl)- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SC(CC)C)nc2c1c(=O)[nH]c(=O)n2C

STK834374
Synonyms: 4- ({3- [butyl(dimethyl)ammonio]propanoyl}amino)- 4- methyltetrahydrothiophene- 3- sulfonate1,1- dioxide
Smiles: CCCC[N+](CCC(=O)NC1(C)CS(=O)(=O)CC1S(=O)(=O)[O-])(C)C

STK528468
Synonyms: 2- [(7- nitro- 2,1,3- benzoxadiazol- 4- yl)amino]benzoicacid
Smiles: [O-][N+](=O)c1ccc(c2c1non2)Nc1ccccc1C(=O)O

STK834375
Synonyms: 1,7- dibenzyl- 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCSc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK528469
Synonyms: (2E)- 1- [2,4- bis(benzyloxy)phenyl]- 3- (2- methoxyphenyl)prop- 2- en- 1- one
Smiles: COc1ccccc1/C=C/C(=O)c1ccc(cc1OCc1ccccc1)OCc1ccccc1

STK528472
Synonyms: diethyl{cyano[4- (dimethylamino)- 6- (methylsulfanyl)- 1,3,5- triazin- 2- yl]amino}propanedioate
Smiles: CCOC(=O)C(N(c1nc(SC)nc(n1)N(C)C)C#N)C(=O)OCC

STK528473
Synonyms: N- (2,4- dimethylphenyl)- 3- (tetrahydrofuran- 2- yl)butanamide
Smiles: O=C(Nc1ccc(cc1C)C)CC(C1CCCO1)C

STK528474
Synonyms: N- (4- fluorophenyl)- 2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1)F)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK834381
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(2- ethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1ccc2c(c1)OCO2

STK528480
Synonyms: 4- [4- (2- fluorophenyl)piperazin- 1- yl]- 8- methoxy- 5H- pyrimido[5,4- b]indole
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1ccccc1F

STK528482
Synonyms: (2E)- 3- [(3,4- dichlorophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK834387
Synonyms: (2Z,4E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 5- (2- nitrophenyl)penta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccccc1[N+](=O)[O-])/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834389
Synonyms: 5- (piperidin- 1- yl)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1c(ccc3no2)N1CCCCC1

STK528486
Synonyms: (2E)- 3- (naphthalen- 2- ylamino)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccc2)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528487
Synonyms: N'- [(E)- (3,5- dichloro- 2- hydroxyphenyl)methylidene]- 4,6- diphenylpyrimidine- 2- carbohydrazide
Smiles: Clc1cc(/C=N/NC(=O)c2nc(cc(n2)c2ccccc2)c2ccccc2)c(c(c1)Cl)O

STK528490
Synonyms: 1,2- di(morpholin- 4- yl)- 2- phenylethanone
Smiles: O=C(C(c1ccccc1)N1CCOCC1)N1CCOCC1

STK834392
Synonyms: ethyl{[4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]amino}(oxo)acetate
Smiles: CCOC(=O)C(=O)Nc1scc(n1)c1ccc(cc1)Cl

STK528491
Synonyms: 7- [2- (4- bromophenyl)- 2- oxoethyl]- 1,3- dimethyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1ccc(cc1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1

STK528493
Synonyms: (2H- [1,2,4]triazino[5,6- b]indol- 3- ylsulfanyl)aceticacid
Smiles: OC(=O)CSc1[nH]nc2c(n1)nc1c2cccc1

STK528494
Synonyms: 1- (4- ethoxyphenyl)- N- [(1- phenylcyclopentyl)methyl]methanamine
Smiles: CCOc1ccc(cc1)CNCC1(CCCC1)c1ccccc1

STK528496
Synonyms: 2- (4- methoxyphenyl)- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinoline- 6- carboxylicacid
Smiles: COc1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)ccc3C(=O)O

STK834400
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 8- (propan- 2- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C)O

STK528503
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- {[2- chloro- 5- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(ccc1Cl)C(F)(F)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK528505
Synonyms: 4- [4- (4- fluorophenyl)piperazin- 1- yl]- 5H- pyrimido[5,4- b]indole
Smiles: Fc1ccc(cc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK834401
Synonyms: (4E)- 2- benzyl- 4- (4- methoxybenzylidene)- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)/C=C/1\C(=NN(C1=O)Cc1ccccc1)C

STK528508
Synonyms: (2E)- 3- [(3,4- dimethylphenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)C)C)/c1scc(n1)c1ccc(cc1)CC(C)C

STK834402
Synonyms: 1,1'- (2,2- dichloroethene- 1,1- diyl)bis(4- methoxy- 3- methylbenzene)
Smiles: COc1ccc(cc1C)C(=C(Cl)Cl)c1ccc(c(c1)C)OC

STK528511
Synonyms: methyl3- ({[4- (4- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK528512
Synonyms: (diphenoxyphosphoryl)phosphoramidicacid
Smiles: O=P(NP(=O)(O)O)(Oc1ccccc1)Oc1ccccc1

STK834403
Synonyms: 6- oxo- N- phenyl- 6H- anthra[1,9- cd][1,2]oxazole- 3- carboxamide
Smiles: O=C1c2ccccc2c2c3c1ccc(c3no2)C(=O)Nc1ccccc1

STK528514
Synonyms: 3- {4- [4- (4,6- dimethylpyrimidin- 2- yl)piperazin- 1- yl]butyl}- 1,8,8- trimethyl- 3- azabicyclo[3.2.1]octane- 2,4- dione
Smiles: Cc1cc(C)nc(n1)N1CCN(CC1)CCCCN1C(=O)C2CCC(C1=O)(C2(C)C)C

STK834404
Synonyms: 2- (2,3- dihydro- 1,4- benzodioxin- 2- ylcarbonyl)hydrazinecarbothioamide
Smiles: NC(=S)NNC(=O)C1COc2c(O1)cccc2

STK834405
Synonyms: 1- {2- [(2,4- dichlorobenzyl)oxy]- 2- (2,4- dichlorophenyl)ethyl}- 1H- imidazole
Smiles: Clc1ccc(c(c1)Cl)COC(c1ccc(cc1Cl)Cl)Cn1cncc1

STK834406
Synonyms: 1- [3- (morpholin- 4- yl)propyl]- 2- phenyl- 1H- imidazo[1,2- a]benzimidazole
Smiles: O1CCN(CC1)CCCn1c(cn2c1nc1c2cccc1)c1ccccc1

STK528520
Synonyms: (3Z)- 3- [(4- ethoxyphenyl)imino]- 1- (morpholin- 4- ylmethyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CCOc1ccc(cc1)/N=C/1\C(=O)N(c2c1cccc2)CN1CCOCC1

STK834410
Synonyms: 3- [(2- chlorophenyl)carbonyl]- 2,6- dimethyl- 4H- chromen- 4- one
Smiles: Cc1ccc2c(c1)c(=O)c(c(o2)C)C(=O)c1ccccc1Cl

STK834411
Synonyms: ethyl1- amino- 3- (propan- 2- yl)- 3,4- dihydronaphthalene- 2- carboxylate
Smiles: CCOC(=O)C1=C(N)c2c(CC1C(C)C)cccc2

STK528524
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- (4- ethoxyphenyl)prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)/C=C(\c1scc(n1)c1ccc(cc1Cl)Cl)/C#N

STK528525
Synonyms: N,N- diethyl- 3- (2- phenyl- 1H- imidazo[1,2- a]benzimidazol- 1- yl)propan- 1- amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccccc1)CC

STK528529
Synonyms: (2E)- 3- [(3,5- dimethylphenyl)amino]- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(C)cc(c1)C)/c1scc(n1)c1ccc(cc1C)C

STK528530
Synonyms: (2E)- 1- methyl- 2- [1- (2- oxo- 2H- chromen- 3- yl)ethylidene]hydrazinecarbothioamide
Smiles: NC(=S)N(/N=C(/c1cc2ccccc2oc1=O)\C)C

STK834414
Synonyms: (2E)- 3- [(4- methylphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK528531
Synonyms: N- [4- ({2- methoxy- 5- [(E)- (1H- 1,2,4- triazol- 1- ylimino)methyl]benzyl}oxy)phenyl]acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=N/n1ncnc1

STK834415
Synonyms: 2- (piperidin- 1- yl)benzo[cd]indole
Smiles: C1CCN(CC1)C1=Nc2c3c1cccc3ccc2

STK528534
Synonyms: {1- [(1Z)- 1- (furan- 2- yl)- 3- oxo- 3- phenylprop- 1- en- 2- yl]pyridin- 2(1H)- ylidene}propanedinitrile
Smiles: N#CC(=c1ccccn1/C(=C\c1ccco1)/C(=O)c1ccccc1)C#N

STK834416
Synonyms: 1- (3,6- dichloro- 9H- carbazol- 9- yl)- 3- [(4- methylphenyl)amino]propan- 2- ol
Smiles: Cc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK834419
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (4- ethylphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)CC)/c1scc(n1)c1ccc2c(c1)OCO2

STK528539
Synonyms: 4,4'- (furan- 2- ylmethanediyl)bis(1- hexyl- 3- methyl- 1H- pyrazol- 5- ol)
Smiles: CCCCCCn1nc(c(c1O)C(c1c(C)nn(c1O)CCCCCC)c1ccco1)C

STK834421
Synonyms: (2Z)- 3- [(3,5- dichlorophenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)cc(c1)Cl)/c1scc(n1)c1ccccc1

STK528542
Synonyms: N- [(4- propoxyphenyl)carbonyl]glycine
Smiles: CCCOc1ccc(cc1)C(=O)NCC(=O)O

STK834422
Synonyms: ethyl{[7- (3- bromobenzyl)- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK528548
Synonyms: 5- [(2E)- 3- phenylprop- 2- en- 1- yl]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)NC(=O)C1C/C=C/c1ccccc1

STK528550
Synonyms: ethyl3- ({[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccco1)cc(cc2)OC

STK834426
Synonyms: (2Z)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- (3- nitrophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)OC)OC

STK528552
Synonyms: (2E)- 3- (2,4- dichlorophenyl)- 1- [4- (octyloxy)phenyl]prop- 2- en- 1- one
Smiles: CCCCCCCCOc1ccc(cc1)C(=O)/C=C/c1ccc(cc1Cl)Cl

STK834427
Synonyms: N- benzyl- 6- oxo- 6H- anthra[1,9- cd][1,2]oxazole- 3- carboxamide
Smiles: O=C1c2ccccc2c2c3c1ccc(c3no2)C(=O)NCc1ccccc1

STK528561
Synonyms: (2E)- 3- [(3- butoxyphenyl)amino]- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1ccc(cc1Cl)Cl)\C#N

STK528564
Synonyms: N- benzyl- 2- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1Cl)c1nc(NCc2ccccc2)c2c(n1)cccc2

STK528566
Synonyms: 5- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 6- hydroxy- 3- methyl- 2- (propylsulfanyl)pyrimidin- 4(3H)- one
Smiles: CCCSc1nc(O)c(c(=O)n1C)C1OC(=O)c2c1ccc(c2OC)OC

STK528571
Synonyms: N- methyl- 5- nitrospiro[benzimidazole- 2,1'- cyclohexan]- 4- amine1- oxide
Smiles: CNc1c(ccc2=[N+](C3(N=c12)CCCCC3)[O-])[N+](=O)[O-]

STK834431
Synonyms: (2E)- 3- [(2- ethylphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1cc2ccccc2oc1=O

STK528574
Synonyms: 1,5- dimethyl- 9- oxo- N,N'- di(prop- 2- en- 1- yl)- 3,7- diazabicyclo[3.3.1]nonane- 3,7- dicarbothioamide
Smiles: C=CCNC(=S)N1CC2(C)CN(CC(C1)(C2=O)C)C(=S)NCC=C

STK834432
Synonyms: 7- benzyl- 3- methyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(Cc1ccccc1)c(n2)N1CCCCC1)C

STK528578
Synonyms: 5- (3,4- dihydroquinolin- 1(2H)- ylcarbonyl)- 4,6- dimethyl- 2H- pyran- 2- one
Smiles: O=c1cc(C)c(c(o1)C)C(=O)N1CCCc2c1cccc2

STK528579
Synonyms: 4- (4- cyclohexylpiperazin- 1- yl)- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)C1CCCCC1

STK834433
Synonyms: (2Z)- 3- [(3- chloro- 2- methylphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)Cl)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK528581
Synonyms: 4- (3,4- dihydroisoquinolin- 2(1H)- yl)- 5H- pyrimido[5,4- b]indole
Smiles: c1ccc2c(c1)CN(CC2)c1ncnc2c1[nH]c1c2cccc1

STK834435
Synonyms: 1,4- dicyclohexyltetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: O=C1NC2C(N1C1CCCCC1)NC(=O)N2C1CCCCC1

STK528586
Synonyms: ethyl5- (phenoxymethyl)furan- 2- carboxylate
Smiles: CCOC(=O)c1ccc(o1)COc1ccccc1

STK528588
Synonyms: (2Z)- 3- [(2,5- dimethylphenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1C)/c1scc(n1)c1cccc(c1)OC

STK528592
Synonyms: 8- (1,3- benzothiazol- 2- ylsulfanyl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(Sc2nc3c(s2)cccc3)nc2c1c(=O)[nH]c(=O)n2C

STK528594
Synonyms: 3- [4- (4- cyclohexylpiperazin- 1- yl)but- 2- yn- 1- yl]- 1,8,8- trimethyl- 3- azabicyclo[3.2.1]octane- 2,4- dione
Smiles: O=C1N(CC#CCN2CCN(CC2)C2CCCCC2)C(=O)C2(C(C1CC2)(C)C)C

STK528597
Synonyms: 3- [4- (octyloxy)phenyl]- 1,5- diphenylpentane- 1,5- dione
Smiles: CCCCCCCCOc1ccc(cc1)C(CC(=O)c1ccccc1)CC(=O)c1ccccc1

STK834440
Synonyms: 4- hydroxy- N- (4- methylphenyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK834441
Synonyms: (2E)- 3- [(4- ethoxyphenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)F)\C#N

STK528600
Synonyms: (2Z)- 3- [(3,5- dichlorophenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)cc(c1)Cl)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK528602
Synonyms: 1- (3- chlorophenyl)- 3- (5,6,7,8- tetrahydrospiro[3,1- benzothiazine- 4,1'- cyclohexan]- 2- yl)urea
Smiles: O=C(Nc1cccc(c1)Cl)NC1=NC2=C(C3(S1)CCCCC3)CCCC2

STK834444
Synonyms: (5Z)- 5- (furan- 2- ylmethylidene)- 1- methylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)NC(=O)/C(=C/c2ccco2)/C1=O

STK528604
Synonyms: N- benzyl- 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)NCc1ccccc1)C

STK834445
Synonyms: 1H- benzimidazol- 2- yl(morpholin- 4- yl)methanethione
Smiles: S=C(c1nc2c([nH]1)cccc2)N1CCOCC1

STK528605
Synonyms: (2E)- 3- [(4- bromophenyl)amino]- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Br)/c1scc(n1)c1ccc(cc1)Br

STK528607
Synonyms: 8- methoxy- 3- {[(E)- (4- methoxyphenyl)methylidene]amino}- 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)OC

STK528611
Synonyms: (2Z)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,3- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc(cc1)Br

STK834447
Synonyms: 4- ({3- [(2- hydroxyethyl)(dimethyl)ammonio]propanoyl}amino)- 4- methyltetrahydrothiophene- 3- sulfonate1,1- dioxide
Smiles: OCC[N+](CCC(=O)NC1(C)CS(=O)(=O)CC1S(=O)(=O)[O-])(C)C

STK528616
Synonyms: N,N'- (1Z,2Z)- ethane- 1,2- diylidenebis{N- [(1E)- 1- (hydroxyimino)- 2- methylpropan- 2- yl]amineoxide}
Smiles: O/N=C/C(/[N+](=C/C=[N+](/C(/C=N/O)(C)C)\[O-])/[O-])(C)C

STK528618
Synonyms: N'~1~- {[4- (2- chloroethyl)phenyl]sulfonyl}- N'~2~- phenylethanedihydrazide
Smiles: ClCCc1ccc(cc1)S(=O)(=O)NNC(=O)C(=O)NNc1ccccc1

STK528621
Synonyms: 2- (3,4- dichlorophenyl)- N- (3- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1cccc(c1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528624
Synonyms: N'- [(3E)- 5- bromo- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 3- carbohydrazide
Smiles: Brc1ccc2c(c1)/C(=N\NC(=O)c1cccnc1)/C(=O)N2CN1CCCCC1c1cccnc1

STK834452
Synonyms: 2- [(Z)- [4- (dimethylamino)benzylidene](oxido)- lambda~5~- azanyl]- 2- methylcyclohexanone
Smiles: O=C1CCCCC1(C)/[N+](=C/c1ccc(cc1)N(C)C)/[O-]

STK834455
Synonyms: (2Z)- 3- [(2,5- dimethoxyphenyl)amino]- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: COc1ccc(c(c1)N/C=C(\c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1)/C#N)OC

STK528626
Synonyms: 3- (1,3- benzothiazol- 2- ylsulfanyl)- 4,6,6- trimethyl- 5,6- dihydropyridin- 2(1H)- one
Smiles: CC1=C(Sc2nc3c(s2)cccc3)C(=O)NC(C1)(C)C

STK834458
Synonyms: (2E)- 2- [4- (2- oxo- 2H- chromen- 3- 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)c1cc2ccccc2oc1=O

STK528628
Synonyms: (2E)- 3- [(2- methyl- 4- nitrophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1cc2ccccc2oc1=O

STK834459
Synonyms: (2Z,4E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 5- (4- nitrophenyl)penta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1Cl)Cl

STK834460
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK528634
Synonyms: N- cyclohexyl- 2- [(4- nitrophenyl)carbonyl]hydrazinecarboxamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])NNC(=O)NC1CCCCC1

STK834462
Synonyms: 7- benzyl- 3- methyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(Cc1ccccc1)c(n2)S)C

STK528640
Synonyms: (3E)- 3- {[4- (4- nitrophenyl)piperazin- 1- yl]methylidene}- 2,3- dihydropyrrolo[2,1- b]quinazolin- 9(1H)- one
Smiles: [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)/C=C/1\CCn2c1nc1ccccc1c2=O

STK834463
Synonyms: 2- (methylamino)cyclohepta- 2,4,6- triene- 1- thione
Smiles: CNc1cccccc1=S

STK528642
Synonyms: 4- [4- (4- chlorophenyl)piperazin- 1- yl]- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Clc1ccc(cc1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)C

STK528647
Synonyms: 2- ({3- oxo- 3- [(5- propyl- 1,3,4- thiadiazol- 2- yl)amino]propanoyl}amino)benzoicacid
Smiles: CCCc1nnc(s1)NC(=O)CC(=O)Nc1ccccc1C(=O)O

STK834466
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [(2- methoxyphenyl)amino]propan- 2- ol
Smiles: COc1ccccc1NCC(Cn1c2ccccc2c2c1cccc2)O

STK528649
Synonyms: 2- {4- [2- hydroxy- 3- (propan- 2- ylamino)propoxy]phenyl}acetamide
Smiles: OC(COc1ccc(cc1)CC(=O)N)CNC(C)C

STK528652
Synonyms: (2Z)- 3- [(5- chloro- 2- methoxyphenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1OC)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK834467
Synonyms: 3- hydroxy- N'- [(1E)- 1- (2- oxo- 2H- chromen- 3- yl)ethylidene]naphthalene- 2- carbohydrazide
Smiles: O=C(c1cc2ccccc2cc1O)N/N=C(/c1cc2ccccc2oc1=O)\C

STK834469
Synonyms: 2- (4- bromophenyl)- N- (4- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)Br

STK834470
Synonyms: (2Z)- 2- cyano- 2- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- N- (2- methylphenyl)ethanamide
Smiles: N#C/C(=C\1/NC(C)(C)Cc2c1cccc2)/C(=O)Nc1ccccc1C

STK528663
Synonyms: 5- (bromomethyl)- N- (3- nitrophenyl)- 4,5- dihydro- 1,3- thiazol- 2- amine
Smiles: BrCC1CN=C(S1)Nc1cccc(c1)[N+](=O)[O-]

STK834474
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- chlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc(cc1)Br

STK528665
Synonyms: 4- ({[(3- nitrophenyl)amino](oxo)acetyl}amino)benzoicacid
Smiles: O=C(C(=O)Nc1ccc(cc1)C(=O)O)Nc1cccc(c1)[N+](=O)[O-]

STK528668
Synonyms: 3- (tert- butylsulfanyl)- 2,3- dihydrothiophene1,1- dioxide
Smiles: CC(SC1C=CS(=O)(=O)C1)(C)C

STK528674
Synonyms: (3aS,6aS)- 5- (3- fluorophenyl)- 3- [(4- fluorophenyl)carbonyl]- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)C(=O)C1=NN[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)F

STK528675
Synonyms: (2E)- 3- [(3,4- dichlorophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1ccc(cc1)C

STK528679
Synonyms: ({7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)aceticacid
Smiles: OC(Cn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl

STK528681
Synonyms: N- (2- chlorophenyl)- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)quinoxalin- 2- amine
Smiles: Cc1cc(n(n1)c1nc2ccccc2nc1Nc1ccccc1Cl)C

STK834480
Synonyms: 2- amino- 4- (thiophen- 2- yl)- 4H- [1]benzothieno[3,2- b]pyran- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccs1)sc1c2cccc1

STK834481
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (phenylamino)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1)/c1scc(n1)c1ccc2c(c1)OCO2

STK834482
Synonyms: N- ethyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK834485
Synonyms: (2E)- 3- (naphthalen- 1- ylamino)- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1cccc2)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK528695
Synonyms: 4- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}benzoicacid
Smiles: COc1ccc(cc1OC)/C=N/c1ccc(cc1)C(=O)O

STK528696
Synonyms: 4- {(E)- [4- chloro- 2- (prop- 2- en- 1- yloxy)phenyl]diazenyl}benzoicacid
Smiles: C=CCOc1cc(Cl)ccc1/N=N/c1ccc(cc1)C(=O)O

STK528697
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK528709
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1ccc(cc1)Br

STK528711
Synonyms: 2- (4- benzylpiperidin- 1- yl)- 1- (1H- indol- 3- yl)ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCC(CC1)Cc1ccccc1

STK834493
Synonyms: (4E,7E)- N,N'- dihydroxy- 2,2- dimethyl- 5,6- dihydro- 2H- benzimidazole- 4,7- diimine1,3- dioxide
Smiles: O/N=C/1\CC/C(=N\O)/C2=[N+](C([N+](=C12)[O-])(C)C)[O-]

STK528716
Synonyms: 5- [(E)- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}methyl]- 2- oxo- 4- (pyridinium- 1- yl)- 1,3- thiazol- 3- ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1O)[n+]1ccccc1

STK528721
Synonyms: 2,2'- (2- oxo- 2,3- dihydro- 1H- indole- 3,3- diyl)bis(5,5- dimethylcyclohexane- 1,3- dione)
Smiles: O=C1CC(C)(C)CC(=O)C1C1(C(=O)Nc2c1cccc2)C1C(=O)CC(CC1=O)(C)C

STK528723
Synonyms: 2- chloro- 3H- naphtho[1,2- d]imidazole
Smiles: Clc1nc2c([nH]1)ccc1c2cccc1

STK528725
Synonyms: 6- chloro- 2- (trifluoromethyl)- 3H- imidazo[4,5- b]pyridine
Smiles: Clc1cnc2c(c1)nc([nH]2)C(F)(F)F

STK528726
Synonyms: (2E)- 3- (naphthalen- 2- ylamino)- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccc2)/c1scc(n1)c1cc2ccccc2oc1=O

STK528727
Synonyms: 5- (azepan- 1- ylcarbonyl)- 4,6- dimethyl- 2H- pyran- 2- one
Smiles: O=c1cc(C)c(c(o1)C)C(=O)N1CCCCCC1

STK528728
Synonyms: 3- imino- 1,7- dimethyl- 5- (propan- 2- yl)- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1C(C)C)(C(C2(C#N)C#N)C)C

STK834499
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1ccc(cc1Cl)Cl

STK834502
Synonyms: (2E)- 3- [(4- iodophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)I)/c1scc(n1)c1cc2ccccc2oc1=O

STK834503
Synonyms: 3- (1,1- dioxidotetrahydrothiophen- 3- yl)tetrahydrothieno[3,4- d][1,3]thiazole- 2(3H)- thione5,5- dioxide
Smiles: S=C1SC2C(N1C1CCS(=O)(=O)C1)CS(=O)(=O)C2

STK528733
Synonyms: N'- [(4Z)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylidene]- 4- oxo- 3,4- dihydrophthalazine- 1- carbohydrazide
Smiles: O=C(c1n[nH]c(=O)c2c1cccc2)N/N=C\1/CCCc2c1non2

STK528734
Synonyms: 1- (3,4- dichlorophenyl)- 2- (2- imino- 3- propyl- 2,3- dihydro- 1H- benzimidazol- 1- yl)ethanol
Smiles: CCCn1c(=N)n(c2c1cccc2)CC(c1ccc(c(c1)Cl)Cl)O

STK834506
Synonyms: 2- [(7- benzyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK528736
Synonyms: 3- [(7- heptyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]propanoicacid
Smiles: CCCCCCCn1c(SCCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK528738
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- N- (propan- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NC(C)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK528739
Synonyms: (2Z,4E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 5- (2- nitrophenyl)penta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccccc1[N+](=O)[O-])/c1scc(n1)c1ccc(cc1Cl)Cl

STK834514
Synonyms: 7- methyl- 7- (morpholin- 4- yl)- 4,5,7,8- tetrahydro- 8aH- [1,2,5]oxadiazolo[3,4- e]indol- 8a- ol3,6- dioxide
Smiles: [O-][N+]1=C2CCc3c(C2(CC1(C)N1CCOCC1)O)no[n+]3[O-]

STK528747
Synonyms: N'- benzyl- 2- (morpholin- 4- yl)- N'- phenylacetohydrazide
Smiles: O=C(NN(c1ccccc1)Cc1ccccc1)CN1CCOCC1

STK834516
Synonyms: 1- [2- imino- 3- (prop- 2- en- 1- yl)- 2,3- dihydro- 1H- benzimidazol- 1- yl]- 3,3- dimethylbutan- 2- ol
Smiles: C=CCn1c(=N)n(c2c1cccc2)CC(C(C)(C)C)O

STK528753
Synonyms: (2E)- 3- [(2- methyl- 4- nitrophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)C

STK834518
Synonyms: N- (4- bromophenyl)- 2- {[3- cyano- 4- (furan- 2- yl)- 6- phenylpyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)Br)nc(cc1c1ccco1)c1ccccc1

STK528761
Synonyms: (2E)- 3- phenyl- 1- (2,4,5- trimethylphenyl)prop- 2- en- 1- one
Smiles: O=C(c1cc(C)c(cc1C)C)/C=C/c1ccccc1

STK834521
Synonyms: 2- methyl- 1- (naphthalen- 1- ylmethyl)- 4- nitro- 1H- imidazole
Smiles: [O-][N+](=O)c1cn(c(n1)C)Cc1cccc2c1cccc2

STK528764
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(3- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/c1scc(n1)c1ccc(cc1Cl)Cl

STK834522
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)[N+](=O)[O-])/C#N

STK528767
Synonyms: N'- [(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/1\CCCc2c1non2

STK834526
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 8- (propylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCSc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C

STK834528
Synonyms: (2Z)- 3- [(3- chloro- 2- methylphenyl)amino]- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)Cl)/c1scc(n1)c1ccc(c(c1)OC)OC

STK528774
Synonyms: (2Z)- 3- [(4- ethylphenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)CC)/c1scc(n1)c1ccccc1

STK528775
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- butoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1cc2cc(Br)ccc2oc1=O)\C#N

STK834530
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- ethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1ccc(cc1)Cl

STK528777
Synonyms: 8- {4- [2- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)- 2- oxoethyl]piperazin- 1- yl}- 3- methyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)c1c(C)n(c2c1cc(OC)cc2)C

STK834531
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(2,3- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc2c(c1)OCO2

STK528779
Synonyms: (2E)- 3- [(4- nitrophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1cc2ccccc2oc1=O

STK528780
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(3- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1ccc(cc1Cl)Cl

STK528781
Synonyms: (2E)- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- iodophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccc(cc1)CC

STK528783
Synonyms: (2E)- 3- [(3- fluorophenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/c1scc(n1)c1ccccc1

STK528785
Synonyms: 4- ({[bis(propan- 2- yloxy)phosphoryl](phenyl)methyl}amino)benzoicacid
Smiles: CC(OP(=O)(C(c1ccccc1)Nc1ccc(cc1)C(=O)O)OC(C)C)C

STK528788
Synonyms: 4,6- dimethyl- N- (2- methylpropyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: CC(CNC(=O)c1c(C)cc(=O)oc1C)C

STK834534
Synonyms: (2Z)- 3- [(5- chloro- 2- methoxyphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1OC)/c1scc(n1)c1ccc(cc1)C

STK528790
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 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)c1ccc(cc1Cl)Cl

STK528794
Synonyms: (2E)- 3- [(3- bromophenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK528795
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- chlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1cccc(c1)Br

STK528798
Synonyms: 1,3- dimethyl- 3a,6a- diphenyltetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: O=C1NC2(C(N1)(c1ccccc1)N(C(=O)N2C)C)c1ccccc1

STK834536
Synonyms: (3Z)- 3- (naphthalen- 1- ylmethylidene)- 2- benzofuran- 1(3H)- one
Smiles: O=C1O/C(=C\c2cccc3c2cccc3)/c2c1cccc2

STK834537
Synonyms: (5E)- 5- benzylidene- 3- [3- (9H- carbazol- 9- yl)- 2- hydroxypropyl]- 1,3- thiazolidine- 2,4- dione
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CN1C(=O)S/C(=C/c2ccccc2)/C1=O

STK528803
Synonyms: 2,5- bis[3- (oxiran- 2- ylmethoxy)phenyl]- 1,3,4- oxadiazole
Smiles: c1cc(OCC2CO2)cc(c1)c1nnc(o1)c1cccc(c1)OCC1CO1

STK528804
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 2- ylamino)prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)cccc2)/C#N

STK528805
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- ethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1cccc(c1)Br

STK528806
Synonyms: {[3- methyl- 2,6- dioxo- 7- (prop- 2- en- 1- yl)- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}aceticacid
Smiles: C=CCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK528808
Synonyms: 2- [(3- bromo- 4- methoxyphenyl)acetyl]- N- methylhydrazinecarbothioamide
Smiles: CNC(=S)NNC(=O)Cc1ccc(c(c1)Br)OC

STK528811
Synonyms: N- (diphenylacetyl)- beta- alanyl- beta- alanine
Smiles: O=C(NCCC(=O)O)CCNC(=O)C(c1ccccc1)c1ccccc1

STK528813
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 1- ylamino)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1cccc2)/c1scc(n1)c1ccc(cc1Cl)Cl

STK528817
Synonyms: 1- [2- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)- 2- oxoethyl]piperidine- 4- carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCC(CC1)C(=O)N)c(n2C)C

STK528818
Synonyms: N- (butan- 2- yl)- 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCC(NC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F)C

STK834545
Synonyms: (4E)- 4- (hydroxyimino)- 2- phenyl- 4,5,6,7- tetrahydro- 1H- benzimidazol- 1- ol
Smiles: O/N=C/1\CCCc2c1nc(n2O)c1ccccc1

STK834546
Synonyms: 3- (1H- benzimidazol- 2- yl)- 1- butyl- 4- hydroxyquinolin- 2(1H)- one
Smiles: CCCCn1c(=O)c(c2nc3c([nH]2)cccc3)c(c2c1cccc2)O

STK834547
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(2- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1F)/c1scc(n1)c1ccc2c(c1)OCO2

STK528819
Synonyms: 1- (3,4- dimethoxybenzyl)- 3,5- dimethyl- 1H- pyrazole
Smiles: COc1cc(ccc1OC)Cn1nc(cc1C)C

STK528823
Synonyms: (2E)- 3- [(3,5- dimethylphenyl)amino]- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(C)cc(c1)C)/c1scc(n1)c1ccccc1

STK834548
Synonyms: (2Z)- N- (2,4- dichlorophenyl)- 2- (6,7- dimethoxy- 3,3- dimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanamide
Smiles: COc1cc2/C(=C/C(=O)Nc3ccc(cc3Cl)Cl)/NC(Cc2cc1OC)(C)C

STK528825
Synonyms: N'- [(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]- 2- hydroxy- 2,2- bis(4- methylphenyl)acetohydrazide
Smiles: Cc1ccc(cc1)C(c1ccc(cc1)C)(C(=O)N/N=C/c1cc(Br)cc(c1O)Br)O

STK528826
Synonyms: propan- 2- yl[(3,7- dimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetate
Smiles: CC(OC(=O)CSc1nc2c(n1C)c(=O)[nH]c(=O)n2C)C

STK528829
Synonyms: (2Z)- 3- [(2,5- dichlorophenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1Cl)/c1scc(n1)c1ccc(cc1)C

STK834549
Synonyms: 2- (2H- benzotriazol- 2- yl)- 4- methyl- 6- (prop- 2- en- 1- yl)phenol
Smiles: C=CCc1cc(C)cc(c1O)n1nc2c(n1)cccc2

STK528830
Synonyms: 4- [4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: COc1cccc(c1)N1CCN(CC1C)c1ncnc2c1[nH]c1c2cc(cc1)C

STK834550
Synonyms: ethyl4- ({(E)- 2- cyano- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(c(c1)Cl)Cl)\C#N

STK528836
Synonyms: 4- hydroxy- N- [(4- hydroxyphenyl)sulfonyl]- N- (trimethylstannanyl)benzenesulfonamide
Smiles: Oc1ccc(cc1)S(=O)(=O)N(S(=O)(=O)c1ccc(cc1)O)[Sn](C)(C)C

STK528838
Synonyms: (2Z)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1ccc(cc1)Br

STK528844
Synonyms: (2Z)- 3- [(3,4- dimethylphenyl)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(c(c1)C)C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK528846
Synonyms: (2E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- 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)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834560
Synonyms: 3,7- dimethyl- 8- (pentylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK528848
Synonyms: 2,2- dimethyl- 7,7- dinitro- 2,5,6,7- tetrahydro- 4H- benzimidazol- 4- one1,3- dioxide
Smiles: O=C1CCC(C2=[N+](C([N+](=C12)[O-])(C)C)[O-])([N+](=O)[O-])[N+](=O)[O-]

STK528850
Synonyms: (2E)- 3- [(4- bromophenyl)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)Br)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834561
Synonyms: (2Z)- 3- [(3- chloro- 2- methylphenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)Cl)/c1scc(n1)c1cccc(c1)OC

STK834562
Synonyms: 4- methyl- 4- {[3- (trimethylammonio)propanoyl]amino}tetrahydrothiophene- 3- sulfonate1,1- dioxide
Smiles: O=C(NC1(C)CS(=O)(=O)CC1S(=O)(=O)[O-])CC[N+](C)(C)C

STK801740
Synonyms: 2- [(7- chloro- 4- nitro- 2,1,3- benzoxadiazol- 5- yl)amino]ethanol
Smiles: [O-][N+](=O)c1c(NCCO)cc(c2c1non2)Cl

STK834563
Synonyms: 2- (2- oxo- 5- pentyltetrahydrofuran- 3- yl)- N- (1,3,4- thiadiazol- 2- yl)acetamide
Smiles: CCCCCC1CC(C(=O)O1)CC(=O)Nc1nncs1

STK528855
Synonyms: (2Z)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(2,3- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK528857
Synonyms: (5E)- 1- (2,5- dimethoxyphenyl)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1N1C(=O)NC(=O)/C(=C\C=C\c2ccco2)/C1=O)OC

STK528859
Synonyms: (2E)- 3- [(4- chlorophenyl)amino]- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)Cl)/C#N

STK528861
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(3- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/c1scc(n1)c1ccc(cc1)Br

STK528871
Synonyms: (2Z)- 3- [(4- ethylphenyl)amino]- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCc1ccc(cc1)N/C=C(\c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1)/C#N

STK834567
Synonyms: (2Z)- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1ccc(cc1)CC

STK528873
Synonyms: 2- (2- chlorophenyl)- 4- (piperidin- 1- yl)quinazoline
Smiles: Clc1ccccc1c1nc(N2CCCCC2)c2c(n1)cccc2

STK528874
Synonyms: methyl4- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C/c1ccc(c(c1)OC)OC

STK528875
Synonyms: 6,8- dimethyl- 7H- benzo[7]annulen- 7- one
Smiles: Cc1cc2ccccc2cc(c1=O)C

STK834570
Synonyms: 1,3- dibenzyl- 5- chloro- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: Clc1ccc2c(c1)n(Cc1ccccc1)c(=O)n2Cc1ccccc1

STK528878
Synonyms: 1- (2- {[4- (2- methyl- 5- oxo- 4- propyltetrahydrofuran- 2- yl)- 1,3- thiazol- 2- yl]amino}ethyl)thiourea
Smiles: CCCC1CC(OC1=O)(C)c1csc(n1)NCCNC(=S)N

STK834572
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc2c(c1)OCO2

STK528883
Synonyms: 4- tert- butyl- 1,3- dimethyl- 3a,6a- diphenyltetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: O=C1N(C)C2(C(N1C)(c1ccccc1)N(C(=O)N2)C(C)(C)C)c1ccccc1

STK528889
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 1- ylamino)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1cccc2)/c1scc(n1)c1cccc(c1)Br

STK528890
Synonyms: {6- [4- (dimethylamino)phenyl]- 2- hydroxy- 2,4- diphenylcyclohex- 3- en- 1- yl}(phenyl)methanone
Smiles: CN(c1ccc(cc1)C1CC(=CC(C1C(=O)c1ccccc1)(O)c1ccccc1)c1ccccc1)C

STK528893
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1c(C)cc(cc1C)C)/c1scc(n1)c1ccc(cc1)Br

STK834575
Synonyms: (2E)- 3- [(4- ethoxyphenyl)amino]- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)OCC)\C#N

STK834576
Synonyms: 8- (ethylsulfanyl)- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SCC)nc2c1c(=O)[nH]c(=O)n2C

STK528900
Synonyms: ethyl6- oxo- 2- phenyl- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc([nH]c1=O)c1ccccc1

STK528901
Synonyms: 4- ({[(4,4- dimethyl- 2,6- dioxocyclohexylidene)methyl]amino}methyl)- N- phenylpiperidine- 1- carbothioamide
Smiles: S=C(N1CCC(CC1)CNC=C1C(=O)CC(CC1=O)(C)C)Nc1ccccc1

STK528907
Synonyms: 2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 3- (4- methylpiperazin- 1- yl)quinoxaline
Smiles: CN1CCN(CC1)c1nc2ccccc2nc1n1nc(cc1C)C

STK834580
Synonyms: 4- [4- (4- bromophenyl)- 6- phenylpyrimidin- 2- yl]morpholine
Smiles: Brc1ccc(cc1)c1nc(nc(c1)c1ccccc1)N1CCOCC1

STK528912
Synonyms: (E)- 1- (dimorpholin- 4- ylphosphoryl)- N- hydroxy- 1- (morpholin- 4- yl)methanimine
Smiles: O/N=C(/P(=O)(N1CCOCC1)N1CCOCC1)\N1CCOCC1

STK528913
Synonyms: methyl5- chloro- 3- ({[4- (diphenylmethyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)cc(cc2)Cl

STK528914
Synonyms: 1- (6- methoxy- 7- methyl- 6H- [1,2,5]oxadiazolo[3,4- e]indol- 8- yl)ethanone
Smiles: COn1c(C)c(c2c1ccc1c2non1)C(=O)C

STK834582
Synonyms: 2,2,5,5- tetramethyl- 4- (thiophen- 2- yl)- 2,5- dihydro- 1H- imidazol- 1- ol
Smiles: ON1C(C)(C)N=C(C1(C)C)c1cccs1

STK528920
Synonyms: N- [(E)- {4- methoxy- 3- [(3- methyl- 4- nitrophenoxy)methyl]phenyl}methylidene]- 1H- 1,2,4- triazol- 1- amine
Smiles: COc1ccc(cc1COc1ccc(c(c1)C)[N+](=O)[O-])/C=N/n1cncn1

STK528923
Synonyms: 2,2,3- trimethyl- 6- (pyrrolidin- 1- yl)hex- 4- yn- 3- ol
Smiles: CC(C(C)(C)C)(C#CCN1CCCC1)O

STK834586
Synonyms: 2- {[3- methyl- 7- (3- methylbutyl)- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}acetamide
Smiles: CC(CCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C)C

STK528927
Synonyms: propan- 2- ylbis(4- bromophenyl)(hydroxy)acetate
Smiles: CC(OC(=O)C(c1ccc(cc1)Br)(c1ccc(cc1)Br)O)C

STK834587
Synonyms: 2- (3- methyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)acetohydrazide
Smiles: NNC(=O)Cn1cnc2c1c(=O)[nH]c(=O)n2C

STK528929
Synonyms: (2E)- 3- [(3,4- dichlorophenyl)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(c(c1)Cl)Cl)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK528931
Synonyms: N- [(1,3- benzodioxol- 5- ylmethyl)carbamoyl]- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NC(=O)NCc1ccc2c(c1)OCO2

STK834590
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(3- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: COc1cccc(c1)N/C=C(/c1scc(n1)c1ccc2c(c1)OCO2)\C#N

STK528936
Synonyms: 2,4- dichloro- N'- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1- yl)benzohydrazide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NNC1=NC(C)(C)Cc2c1cccc2

STK528938
Synonyms: (2Z)- 3- [(2,4- dichlorophenyl)amino]- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=C\Nc1ccc(cc1Cl)Cl)/C#N

STK834591
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- butoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc(cc1)Br)\C#N

STK528940
Synonyms: (2Z)- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- ethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)CC)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK528944
Synonyms: (2Z)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(3- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1)C)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK528945
Synonyms: 7- [(4- methylphenyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc(cc1)Nc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK528946
Synonyms: 3- {[(1E)- 3- (4- tert- butylphenyl)- 2- methylpropylidene]amino}- 8- chloro- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CC(Cc1ccc(cc1)C(C)(C)C)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK528948
Synonyms: 2- (3,4- dichlorophenyl)- N- (3,4- difluorophenyl)quinazolin- 4- amine
Smiles: Fc1ccc(cc1F)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528949
Synonyms:
Smiles: CCCCCS(=O)C1CS(=O)(=O)C[C@@H]1S(=O)CCCCC

STK528950
Synonyms: (2Z)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (3- oxo- 3H- benzo[f]chromen- 2- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK528951
Synonyms: (2Z)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- (4- methoxy- 3- nitrophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])OC)/c1scc(n1)c1ccc(c(c1)OC)OC

STK528952
Synonyms: (2Z)- 3- [(3- chloro- 4- methylphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK528954
Synonyms: (2Z)- 3- [(3- chloro- 2- methylphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)Cl)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834598
Synonyms: (2E)- 3- [(2- fluorophenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1F)/c1scc(n1)c1ccc(cc1)F

STK834600
Synonyms: 1,7- dibenzyl- 3- methyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1n(Cc2ccccc2)c(=O)c2c(n1C)nc(n2Cc1ccccc1)S

STK528960
Synonyms: (2E)- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/c1scc(n1)c1ccc(cc1C)C

STK834606
Synonyms: (2E)- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1[N+](=O)[O-])/c1scc(n1)c1ccc(cc1C)C

STK834607
Synonyms: [(1,3- dimethyl- 2'- nitro- 1H,4'H- spiro[cyclohepta[d]imidazol- 1- ium- 2,1'- cyclohexa[2,5]dien]- 4'- ylidene)(oxido)- lambda~5~- azanyl]oxidanide
Smiles: [O-][N+](=C1C=CC2(C(=C1)[N+](=O)[O-])N(C)C1=CC=CC=CC1=[N+]2C)[O-]

STK528964
Synonyms: 4,5,7- trimethyltetrahydro- 1H- imidazo[4,5- e][1,2,4]triazine- 3,6(2H,4H)- dione
Smiles: O=C1NNC2C(N1C)N(C)C(=O)N2C

STK528970
Synonyms: 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)N)C

STK528973
Synonyms: 4- ethoxy- N- methyl- 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)NC)C

STK834610
Synonyms: (2Z)- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(4- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)C)/c1scc(n1)c1ccc(cc1)CC

STK528978
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1ccc(cc1)Cl

STK834611
Synonyms: 7- amino- 9- (propylsulfanyl)- 8- azaspiro[4.5]deca- 6,9- diene- 6,10- dicarbonitrile
Smiles: CCCSC1=C(C#N)C2(C(=C(N1)N)C#N)CCCC2

STK528979
Synonyms: 4- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK528982
Synonyms: (2Z)- 3- [(4- methylphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)C)/c1scc(n1)c1ccc(cc1)C

STK528987
Synonyms: N- {2- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]propan- 2- yl}- N- nitroso- 3- (trifluoromethyl)aniline
Smiles: O=NN(C(c1nnnn1c1c(C)cccc1C)(C)C)c1cccc(c1)C(F)(F)F

STK834617
Synonyms: 4- methyl- 4- {[3- (4- methylmorpholin- 4- ium- 4- yl)propanoyl]amino}tetrahydrothiophene- 3- sulfonate1,1- dioxide
Smiles: O=C(NC1(C)CS(=O)(=O)CC1S(=O)(=O)[O-])CC[N+]1(C)CCOCC1

STK834618
Synonyms: 4- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 2- methyl- 1,3- thiazole
Smiles: Cc1scc(n1)C1CCOC(C1)(C)C

STK528999
Synonyms: N- (2,6- dimethylphenyl)- 1- (2- oxo- 4- phenylazetidin- 1- yl)cyclohexanecarboxamide
Smiles: O=C1CC(N1C1(CCCCC1)C(=O)Nc1c(C)cccc1C)c1ccccc1

STK529000
Synonyms: 2- [4- (2,3- dimethylphenyl)piperazin- 1- yl]- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cccc(c1C)C)c(n2C)C

STK529001
Synonyms: 2- (hydroxyamino)- 2- methylcyclohexanone
Smiles: ONC1(C)CCCCC1=O

STK529003
Synonyms: 3- [(3,7- dimethyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]propanoicacid
Smiles: OC(=O)CCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK529004
Synonyms: 4,6- dimethyl- N- (6- methylpyridin- 2- yl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1c(C)cc(=O)oc1C

STK529014
Synonyms: 4- (4- cyclohexylpiperazin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: C1CCC(CC1)N1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK834627
Synonyms: 1- [(3- chlorophenyl)amino]- 3- (3,6- dichloro- 9H- carbazol- 9- yl)propan- 2- ol
Smiles: Clc1cccc(c1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK834628
Synonyms: 4- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc2ccccc2n2c1nnc2)/C

STK529016
Synonyms: (2Z)- 3- [(2,4- dichlorophenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK529022
Synonyms: 3,3'- [heptane- 1,7- diylbis(oxybenzene- 4,1- diyl)]dipyrrolidine- 2,5- dione
Smiles: O=C1NC(=O)CC1c1ccc(cc1)OCCCCCCCOc1ccc(cc1)C1CC(=O)NC1=O

STK529023
Synonyms: 4- (pyridin- 4- yl)- 2- sulfanyl- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#Cc1c(S)nc2c(c1c1ccncc1)CCCC2

STK529026
Synonyms: (2Z)- 3- [(2,3- dichlorophenyl)amino]- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1ccc(cc1)CC

STK529032
Synonyms: 1- methyl- 6- (4- phenoxyphenyl)- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: O=C1NC(c2ccccc2)C2=C(N1C)CN(C2=O)c1ccc(cc1)Oc1ccccc1

STK834631
Synonyms: 2- (2- bromo- 4,5- dimethoxybenzyl)- 1H- benzimidazole
Smiles: COc1cc(Cc2nc3c([nH]2)cccc3)c(cc1OC)Br

STK529036
Synonyms: 2- (furan- 2- ylmethyl)- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinoline- 6- carboxylicacid
Smiles: OC(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)Cc1ccco1

STK529037
Synonyms: 2- {[3- cyano- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc2c(c1c1cccs1)CCCC2

STK529043
Synonyms: 1- (3,4- dichlorophenyl)- 2- (3- heptyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)ethanol
Smiles: CCCCCCCn1c(=N)n(c2c1cccc2)CC(c1ccc(c(c1)Cl)Cl)O

STK834634
Synonyms: 2,2- bis(4- chlorophenyl)- 2- hydroxy- N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)C(c1ccc(cc1)Cl)(c1ccc(cc1)Cl)O

STK834635
Synonyms: 8- (azepan- 1- yl)- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCCC1

STK529047
Synonyms: N'- (chloroacetyl)- 2,2- bis(4- fluorophenyl)- 2- hydroxyacetohydrazide
Smiles: ClCC(=O)NNC(=O)C(c1ccc(cc1)F)(c1ccc(cc1)F)O

STK529048
Synonyms: 1,3- dimethyl[1]benzothieno[2,3- c]pyridine
Smiles: Cc1nc(C)c2c(c1)c1ccccc1s2

STK834637
Synonyms: N- (4- methoxyphenyl)- 1H- benzimidazole- 2- carbothioamide
Smiles: COc1ccc(cc1)NC(=S)c1nc2c([nH]1)cccc2

STK834641
Synonyms: 4,6- di- tert- butyl- 2- (2- hydroxyphenyl)- 1,3- benzoxazol- 7- ol
Smiles: Oc1ccccc1c1nc2c(o1)c(O)c(cc2C(C)(C)C)C(C)(C)C

STK834642
Synonyms: (2Z)- 3- [(3- chloro- 2- methylphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)Cl)/c1scc(n1)c1ccc(cc1)C

STK529053
Synonyms: N- [6,6- dimethyl- 4- oxo- 2- (propan- 2- yl)- 5,8- dihydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 3(6H)- yl]- 2- methylpropanamide
Smiles: O=C(C(C)C)Nn1c(nc2c(c1=O)c1CC(C)(C)OCc1s2)C(C)C

STK529057
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1Cl)/c1scc(n1)c1ccc(cc1)Cl

STK529058
Synonyms: ethyl2- (dimethylamino)- 6- (2- fluorophenyl)- 4- (trifluoromethyl)- 4H- 1,3,5- oxadiazine- 4- carboxylate
Smiles: CCOC(=O)C1(N=C(OC(=N1)c1ccccc1F)N(C)C)C(F)(F)F

STK834644
Synonyms: (2Z)- 3- [(2,5- dichlorophenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1Cl)/c1scc(n1)c1ccc(cc1)F

STK529061
Synonyms: 1- (3,4- dichlorophenyl)- 2- {3- [2- (diethylamino)ethyl]- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl}ethanol
Smiles: CCN(CCn1c(=N)n(c2c1cccc2)CC(c1ccc(c(c1)Cl)Cl)O)CC

STK834649
Synonyms: 2- {(1E)- 1- [2- (3- methylquinoxalin- 2- yl)hydrazinylidene]ethyl}phenol
Smiles: Cc1nc2ccccc2nc1N/N=C(/c1ccccc1O)\C

STK834650
Synonyms: (2Z)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- (2- methoxyphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1OC)/c1scc(n1)c1ccc(cc1Cl)Cl

STK529064
Synonyms: methyl1- (2,1,3- benzothiadiazol- 4- yl)- 2- methyl- 5- phenyl- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1cc(n(c1C)c1cccc2c1nsn2)c1ccccc1

STK529065
Synonyms: 1- (4- chlorophenyl)- 3- [3- (trifluoromethyl)quinoxalin- 2- yl]urea
Smiles: O=C(Nc1nc2ccccc2nc1C(F)(F)F)Nc1ccc(cc1)Cl

STK529072
Synonyms: 1- {[(2Z)- 3- methyl- 1,3- benzothiazol- 2(3H)- ylidene]amino}- 3- phenoxypropan- 2- ol
Smiles: OC(C/N=c/1\sc2c(n1C)cccc2)COc1ccccc1

STK834656
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [(4- chlorophenyl)amino]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CNc1ccc(cc1)Cl

STK834658
Synonyms: (2E)- 3- [(2- chlorophenyl)amino]- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccccc1Cl)/C#N

STK529081
Synonyms: (2E)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)OC)OC

STK834660
Synonyms: (2Z)- 3- [(2,5- dimethoxyphenyl)amino]- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)ccc1OC)/c1scc(n1)c1ccc(cc1)F

STK529084
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 8- [(2E)- but- 2- en- 1- ylsulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/CSc1nc2c(n1C/C=C/C)c(=O)[nH]c(=O)n2C

STK529087
Synonyms: (2Z)- 3- [(3- chloro- 2- methylphenyl)amino]- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)Cl)/c1scc(n1)c1ccc(c(c1)C)C

STK529089
Synonyms: 4,6- dimethyl- N- (naphthalen- 1- yl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1cccc2c1cccc2

STK834662
Synonyms: 5,5- dimethyl- 4- phenyl- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: ON1C[N+](=C(C1(C)C)c1ccccc1)[O-]

STK529091
Synonyms: (2E)- 3- [(4- butoxyphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCCCOc1ccc(cc1)N/C=C(/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])\C#N

STK529095
Synonyms: (2Z)- 2- {[(1E)- 1- (hydroxyimino)- 2- methylpropan- 2- yl](oxido)- lambda~5~- azanylidene}- 1- phenylethanone
Smiles: O/N=C/C(/[N+](=C/C(=O)c1ccccc1)/[O-])(C)C

STK529098
Synonyms: (2E)- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834669
Synonyms: (2Z)- 3- (2,4- dimethoxyphenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: COc1ccc(c(c1)OC)/C=C(\c1scc(n1)c1cccc(c1)[N+](=O)[O-])/C#N

STK529100
Synonyms: ethyl4- ({[4- (furan- 2- yl)- 2,6- dioxocyclohexylidene]methyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/C=C/1\C(=O)CC(CC1=O)c1ccco1

STK529101
Synonyms: ethyl2,4- dimethyl- 5- oxo- 3,10b- dihydro- 5H- chromeno[3,4- c]pyridine- 1- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C2C1c1ccccc1OC2=O)C

STK529104
Synonyms: (2Z)- 3- [(2- methylphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK834670
Synonyms: (2Z)- 4- [5- bromo- 3- (5- methylfuran- 2- yl)- 1- benzofuran- 2- yl]- N- hydroxybutan- 2- imine
Smiles: O/N=C(\CCc1oc2c(c1c1ccc(o1)C)cc(cc2)Br)/C

STK529107
Synonyms: 2- methoxy- 4- [(E)- {2- [(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]hydrazinylidene}methyl]phenylthiophene- 2- carboxylate
Smiles: COc1cc(/C=N/NC(=O)c2c(C)onc2c2ccccc2)ccc1OC(=O)c1cccs1

STK834673
Synonyms: 1- [(2Z)- 2- (methylimino)- 1,3- benzothiazol- 3(2H)- yl]- 3- phenoxypropan- 2- ol
Smiles: C/N=c/1\sc2c(n1CC(COc1ccccc1)O)cccc2

STK834674
Synonyms: (2E)- 3- [(4- bromophenyl)amino]- 2- [4- (4- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Br)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK834675
Synonyms: 1- methyl- 6- (3- methylphenyl)- 4- phenyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Cc1cccc(c1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccccc1

STK834676
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(3- methoxyphenyl)amino]prop- 2- enenitrile
Smiles: COc1cccc(c1)N/C=C(/c1scc(n1)c1ccc(cc1)Cl)\C#N

STK834678
Synonyms: 2- {[3- methyl- 2,6- dioxo- 7- (prop- 2- en- 1- yl)- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK529111
Synonyms: 5- cyano- 2- methyl- 6- {[2- oxo- 2- (2- oxo- 2H- chromen- 3- yl)ethyl]sulfanyl}- N- phenyl- 4- (thiophen- 2- yl)pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc(c(c1c1cccs1)C(=O)Nc1ccccc1)C

STK529115
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- ethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1CC)/c1scc(n1)c1ccc(cc1Cl)Cl

STK529118
Synonyms: 7- (3- bromobenzyl)- 8- (ethylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK529120
Synonyms: (2Z)- 3- [(2,4- dichlorophenyl)amino]- 2- [4- (3,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK529125
Synonyms: N- (1,3- benzothiazol- 2- yl)- N'- methylbutanediamide
Smiles: CNC(=O)CCC(=O)Nc1nc2c(s1)cccc2

STK529128
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- {[2- chloro- 5- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(ccc1Cl)C(F)(F)F)/c1scc(n1)c1ccc(cc1)Br

STK834685
Synonyms: 1- (azepan- 1- yl)- 2- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1- yl)ethanone
Smiles: O=C(N1CCCCCC1)CC1=NC(C)(C)Cc2c1cccc2

STK834691
Synonyms: 1,4- bis(5,5- dimethyl- 4,5- dihydro- 1,3- thiazol- 2- yl)piperazine
Smiles: CC1(C)CN=C(S1)N1CCN(CC1)C1=NCC(S1)(C)C

STK529135
Synonyms: 3- [4- (dibutylamino)but- 2- yn- 1- yl]- 5- (propoxymethyl)dihydrofuran- 2(3H)- one(non- preferredname)
Smiles: CCCOCC1OC(=O)C(C1)CC#CCN(CCCC)CCCC

STK529136
Synonyms: 2,2'- {oxybis[(1,3- dioxo- 1,3- dihydro- 2H- isoindole- 5,2- diyl)benzene- 4,1- diyloxy]}diaceticacid
Smiles: OC(=O)COc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)Oc1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)OCC(=O)O

STK834693
Synonyms: (2E)- 1- (2,4- dimethoxyphenyl)- 3- [(5- methyl- 1,2- oxazol- 3- yl)amino]prop- 2- en- 1- one
Smiles: COc1cc(OC)ccc1C(=O)/C=C/Nc1noc(c1)C

STK529139
Synonyms: 3,3'- (4,4'- bipyridinium- 1,1'- diyl)dipropane- 1- sulfonate
Smiles: [O-]S(=O)(=O)CCC[n+]1ccc(cc1)c1cc[n+](cc1)CCCS(=O)(=O)[O-]

STK529141
Synonyms: N- (phenylcarbamothioyl)isoleucine
Smiles: CCC(C(C(=O)O)NC(=S)Nc1ccccc1)C

STK529142
Synonyms: 2,2'- (4H,8H- benzo[1,2- c:4,5- c']bis[1,2,5]oxadiazole- 4,8- diylidene)dipropanedinitrile
Smiles: N#CC(=c1c2nonc2c(=C(C#N)C#N)c2c1non2)C#N

STK529148
Synonyms: 4- (2- chlorophenyl)- 5- cyano- N- (2- methoxyphenyl)- 6- {[2- (4- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: COc1ccc(cc1)C(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1ccccc1Cl

STK529150
Synonyms: (2Z)- 2- [4- (biphenyl- 4- yl)- 1,3- thiazol- 2- yl]- 3- [(4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(cc1)c1ccccc1

STK529151
Synonyms: 3- [2- (4- methoxyphenyl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2cccc1

STK529152
Synonyms: (2Z)- 3- [(2- ethoxyphenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: CCOc1ccccc1N/C=C(\c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])/C#N

STK529156
Synonyms: (2Z)- 3- [(2,5- dichlorophenyl)amino]- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(Cl)ccc1Cl)/c1scc(n1)c1ccc(c(c1)C)C

STK529157
Synonyms: (4E)- N- hydroxy- 2,2- dimethyl- 2,3- dihydro- 4H- pyran- 4- imine
Smiles: O/N=C\1/C=COC(C1)(C)C

STK529160
Synonyms: (2Z)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,3- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1Cl)Cl)/c1scc(n1)c1cccc(c1)Br

STK529163
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- (4- nitrobenzyl)methanamine
Smiles: [O-][N+](=O)c1ccc(cc1)CNCC1COc2c(O1)cccc2

STK834699
Synonyms: 2- methyl- 2- [(Z)- (3- nitrobenzylidene)(oxido)- lambda~5~- azanyl]cyclohexanone
Smiles: O=C1CCCCC1(C)/[N+](=C/c1cccc(c1)[N+](=O)[O-])/[O-]

STK834700
Synonyms: ethyl(2E)- 2- ({(4Z)- 4- [(dimethylamino)methylidene]- 5- oxo- 4,5- dihydrofuran- 2- yl}methylidene)- 3- oxobutanoate
Smiles: CCOC(=O)/C(=C/C1=C/C(=C/N(C)C)/C(=O)O1)/C(=O)C

STK834701
Synonyms: 2- {[3- cyano- 6- methyl- 4- (5- methylfuran- 2- yl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc(cc1c1ccc(o1)C)C

STK529170
Synonyms: ethyl1- (2,1,3- benzothiadiazol- 4- yl)- 2,5- dimethyl- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)c1cc(n(c1C)c1cccc2c1nsn2)C

STK529173
Synonyms: 4- (3- ethylpyridinium- 1- yl)- 5- [(E)- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}methyl]- 2- oxo- 1,3- thiazol- 3- ide
Smiles: CCc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1O

STK834705
Synonyms: 7- (2- chlorobenzyl)- 8- (ethylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCSc1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

STK834706
Synonyms: 3- methyl- 8- [(4- methylbenzyl)sulfanyl]- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)CSc1nc2c(n1C(C)C)c(=O)[nH]c(=O)n2C

STK529178
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2- iodophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK529180
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- 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)c1cc2cc(Br)ccc2oc1=O

STK529187
Synonyms: methyl3- {[(4- carbamoylpiperidin- 1- yl)acetyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C(=O)N)cc(cc2)C

STK834712
Synonyms: (2E)- 3- [(2- methoxyphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC)/c1scc(n1)c1cc2ccccc2oc1=O

STK834713
Synonyms: 2'- (ethylsulfanyl)- 7',7'- dimethyl- 5'- oxo- 5',6',7',8'- tetrahydro- 1'H- spiro[cyclohexane- 1,4'- quinoline]- 3'- carbonitrile
Smiles: CCSC1=C(C#N)C2(C3=C(N1)CC(C)(C)CC3=O)CCCCC2

STK529192
Synonyms: methyl5- chloro- 3- ({[4- (4- fluorophenyl)- 3,6- dihydropyridin- 1(2H)- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=CC1)c1ccc(cc1)F)cc(cc2)Cl

STK834715
Synonyms: 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)ethylpyrrolidine- 1- carbodithioate
Smiles: S=C(N1CCCC1)SCCN1Cc2c(C1=O)cccc2

STK529196
Synonyms: (2E)- 3- [(2- iodophenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK529198
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(2- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1[N+](=O)[O-])/c1scc(n1)c1ccc(cc1Cl)Cl

STK529200
Synonyms: 2- [(E)- (dimorpholin- 4- ylphosphoryl)(hydroxyimino)methyl]hydrazinecarboxamide
Smiles: O/N=C(/P(=O)(N1CCOCC1)N1CCOCC1)\NNC(=O)N

STK529204
Synonyms: 4- amino- N- (butylcarbamoyl)- N- (trimethylstannanyl)benzenesulfonamide
Smiles: CCCCNC(=O)N(S(=O)(=O)c1ccc(cc1)N)[Sn](C)(C)C

STK834717
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(4- methylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK834719
Synonyms: (2Z)- 3- [(2,3- dimethylphenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cccc(c1C)C)/c1scc(n1)c1ccc(cc1)CC(C)C

STK834720
Synonyms: 5- cyano- 4- ethyl- 2- methyl- 6- {[2- oxo- 2- (thiophen- 2- yl)ethyl]sulfanyl}- N- phenylpyridine- 3- carboxamide
Smiles: CCc1c(C#N)c(SCC(=O)c2cccs2)nc(c1C(=O)Nc1ccccc1)C

STK834721
Synonyms: N- [4- (2,4- dimethoxyphenyl)butan- 2- yl]- 3,3- diphenylpropanamide
Smiles: COc1cc(OC)ccc1CCC(NC(=O)CC(c1ccccc1)c1ccccc1)C

STK529213
Synonyms: trimethyl(2S,3S)- bicyclo[2.2.2]octane- 1,2,3- tricarboxylate
Smiles: COC(=O)[C@H]1C2CCC([C@H]1C(=O)OC)(CC2)C(=O)OC

STK834723
Synonyms: 1- ethyl- N- (furan- 2- ylmethyl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCn1c(=O)c(C(=O)NCc2ccco2)c(c2c1cccc2)O

STK529215
Synonyms: N- {2- [(3- cyano- 5- ethyl- 4- methylthiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}furan- 2- carboxamide
Smiles: N#Cc1c(sc(c1C)CC)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccco1

STK529216
Synonyms: ethyl2- (7- nitro- 2,1,3- benzoxadiazol- 4- yl)hydrazinecarboxylate
Smiles: [O-][N+](=O)c1ccc(c2c1non2)NNC(=O)OCC

STK529217
Synonyms: (1E,2E)- N,N'- bis(2- hydroxyethyl)ethanebis(imidothioicacid)
Smiles: OCC/N=C(\C(=N/CCO)\S)/S

STK529219
Synonyms: 2- (3,4- dichlorophenyl)- 4- (pyrrolidin- 1- yl)quinazoline
Smiles: Clc1ccc(cc1Cl)c1nc2ccccc2c(n1)N1CCCC1

STK834725
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (naphthalen- 2- ylamino)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccc2)/c1scc(n1)c1ccc2c(c1)OCO2

STK834726
Synonyms: methyl6- chloro- 2- thioxo- 1,3- benzoxazole- 3(2H)- carboxylate
Smiles: COC(=O)n1c(=S)oc2c1ccc(c2)Cl

STK834729
Synonyms: 4- hydroxy- 2- oxo- N- propyl- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK529224
Synonyms: (2E)- 3- [(3- fluorophenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK529227
Synonyms: 1,8- dimethyl- 4- phenyl- 1,3- dihydro- 2H- 1,5- benzodiazepin- 2- one
Smiles: Cc1ccc2c(c1)N(C)C(=O)CC(=N2)c1ccccc1

STK529228
Synonyms: N- (4- fluorophenyl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1c(C)cc(=O)oc1C

STK529232
Synonyms: 5- [1- (methylamino)ethylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CNC(=C1C(=O)NC(=O)NC1=O)C

STK529235
Synonyms: O- (2- methylpropyl)O- [1- (morpholin- 4- yl)propan- 2- yl]methylphosphonothioate
Smiles: CC(OP(=S)(OCC(C)C)C)CN1CCOCC1

STK529244
Synonyms: ethyl1- methyl- 6- {[(1- methyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 2- oxo- 4- phenyl- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(CSc2nnnn2C)N(C(=O)NC1c1ccccc1)C

STK834735
Synonyms: 5- {1- [(3- methylphenyl)amino]ethylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(=C(Nc2cccc(c2)C)C)C(=O)N1

STK529247
Synonyms: N- (2,4- dimethylphenyl)- 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(cc1C)C)C

STK834738
Synonyms: 6- bromo- 5- methyl- 3H- imidazo[4,5- b]pyridin- 2- ol
Smiles: Brc1cc2nc([nH]c2nc1C)O

STK529252
Synonyms: (2E)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(2,4- dimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK834743
Synonyms: 3- [3- (3,6- dichloro- 9H- carbazol- 9- yl)- 2- hydroxypropyl]- 1,3- thiazolidine- 2,4- dione
Smiles: Clc1ccc2c(c1)c1cc(Cl)ccc1n2CC(CN1C(=O)CSC1=O)O

STK529256
Synonyms: 2- [(E)- 2- (2,2'- bithiophen- 5- yl)ethenyl]quinoline
Smiles: c1csc(c1)c1ccc(s1)/C=C/c1ccc2c(n1)cccc2

STK834745
Synonyms: 8- (benzylamino)- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)COC(C)C

STK834746
Synonyms: N- (2,4- dimethylphenyl)- 7- (morpholin- 4- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: Cc1ccc(c(c1)C)Nc1cc(N2CCOCC2)c2c(c1[N+](=O)[O-])non2

STK529259
Synonyms: 5- ammonio- 3- benzyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- olate
Smiles: O=c1[nH]c(=O)n(c(c1[NH3+])[O-])Cc1ccccc1