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

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STK527926
Synonyms: 4- {[(2- propoxyphenyl)carbonyl]amino}butanoicacid
Smiles: CCCOc1ccccc1C(=O)NCCCC(=O)O

STK527927
Synonyms: 8- [(2E)- 2- (5- bromo- 2- hydroxybenzylidene)hydrazinyl]- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(N/N=C/c2cc(Br)ccc2O)nc2c1c(=O)[nH]c(=O)n2C

STK527929
Synonyms: (5E)- 1- (4- ethoxyphenyl)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)/C(=C\C=C\c2ccco2)/C1=O

STK527931
Synonyms: 2- (4- cyclohexylpiperazin- 1- yl)- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)C1CCCCC1

STK527932
Synonyms: 8- [(1E)- 3- (4- methoxyphenyl)triaz- 1- en- 1- yl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)N/N=N/c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

STK527934
Synonyms: methyl5- bromo- 3- {[(2- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)Br

STK527936
Synonyms: methyl5- chloro- 3- [({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}acetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)Cl

STK527937
Synonyms: 8- {[(2Z)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(SC/C=C(\Cl)/C)nc2c1c(=O)[nH]c(=O)n2C

STK527939
Synonyms: methyl5- chloro- 3- ({[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)cc(cc2)Cl

STK527940
Synonyms: 2- amino- 4- sulfanyl- 3- azaspiro[5.5]undeca- 1,4- diene- 1,5- dicarbonitrile
Smiles: N#CC1=C(N)NC(=C(C21CCCCC2)C#N)S

STK527941
Synonyms: dipropan- 2- yl[(E)- 1- chloro- 2- (methylamino)ethenyl]phosphonate
Smiles: CN/C=C(\P(=O)(OC(C)C)OC(C)C)/Cl

STK527943
Synonyms: 2- (4- chlorophenyl)- 4- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(OC)ccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527944
Synonyms: 2- (2- chlorophenyl)- 4- {(2E)- 2- [1- (4- fluorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Fc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C

STK527945
Synonyms: 3- chloro- 7- (pyrrolidin- 1- yl)- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Clc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)N1CCCC1)c(=O)c1c(c2=O)cccc1

STK527946
Synonyms: pentyl{[7- (3- bromobenzyl)- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK527949
Synonyms: 8- methoxy- 3- {[(1E,2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/C(=C/c1ccccc1)/C

STK527951
Synonyms: 2- {2- imino- 3- [2- (piperidin- 1- yl)ethyl]- 2,3- dihydro- 1H- benzimidazol- 1- yl}- 1- (thiophen- 2- yl)ethanol
Smiles: OC(c1cccs1)Cn1c(=N)n(c2c1cccc2)CCN1CCCCC1

STK527952
Synonyms: 8- (butylsulfanyl)- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527953
Synonyms: methyl5- bromo- 3- ({[4- (2- hydroxyethyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: OCCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK527954
Synonyms: 2- [(3- methyl- 7- nonyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: CCCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK527956
Synonyms: propan- 2- yl6- bromo- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)quinoline- 4- carboxylate
Smiles: CC(OC(=O)c1cc(nc2c1cc(Br)cc2)C12CC3CC(C2)CC(C1)C3)C

STK527957
Synonyms: 6- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1OC)C

STK527958
Synonyms: 7- heptyl- 3- methyl- 8- {(2E)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc2c1c(=O)[nH]c(=O)n2C

STK527960
Synonyms: 3,3'- (1,3- benzodioxol- 5- ylmethanediyl)bis(2- phenyl- 1H- indole)
Smiles: c1ccc(cc1)c1[nH]c2c(c1C(c1c([nH]c3c1cccc3)c1ccccc1)c1ccc3c(c1)OCO3)cccc2

STK527962
Synonyms: 2- (2- chlorophenyl)- 4- [4- (diphenylmethyl)piperazin- 1- yl]quinazoline
Smiles: Clc1ccccc1c1nc2ccccc2c(n1)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK527963
Synonyms: 8- methoxy- 3- (2- phenylethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCc1ccccc1

STK527966
Synonyms: 6- amino- 4- [4- (dimethylamino)phenyl]- 2- thioxo- 1,2- dihydropyridine- 3,5- dicarbonitrile
Smiles: N#Cc1c(N)[nH]c(=S)c(c1c1ccc(cc1)N(C)C)C#N

STK527968
Synonyms: ethyl[(2E)- 2- (4- bromobenzylidene)hydrazinyl](oxo)acetate
Smiles: CCOC(=O)C(=O)N/N=C/c1ccc(cc1)Br

STK527976
Synonyms: 7- hexadecyl- 3- methyl- 8- [(2- methylpropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK527979
Synonyms: 1- [6- methyl- 2- oxo- 3- (propan- 2- yl)cyclohexyl]ethane- 1,1,2,2- tetracarbonitrile
Smiles: CC(C1CCC(C(C1=O)C(C(C#N)C#N)(C#N)C#N)C)C

STK527980
Synonyms: 2- (3,3- dimethylpiperidin- 1- yl)- 1- (2- methyl- 1H- indol- 3- yl)ethanone
Smiles: O=C(c1c(C)[nH]c2c1cccc2)CN1CCCC(C1)(C)C

STK527983
Synonyms: 1- [2- (2,6- dimethoxyphenoxy)ethyl]- 4- (2- methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCOc1c(OC)cccc1OC

STK527985
Synonyms: (4S,5R,6R)- 4- (4- chlorophenyl)- 3- cyano- 6- hydroxy- 6- methyl- 5- (pyridinium- 1- yl)- 1,4,5,6- tetrahydropyridine- 2- thiolate
Smiles: N#CC1=C([S-])N[C@]([C@@H]([C@H]1c1ccc(cc1)Cl)[n+]1ccccc1)(C)O

STK527987
Synonyms: ethyl3- {[3- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(cc2)OC

STK527988
Synonyms: N- dodecyl- 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527990
Synonyms: dipropan- 2- yl{(1Z)- 1- [2- (4- nitrophenyl)hydrazinylidene]- 2- oxoethyl}phosphonate
Smiles: O=C/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/P(=O)(OC(C)C)OC(C)C

STK527992
Synonyms: 8- methoxy- 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]

STK527993
Synonyms: 2- [bis(5- methylfuran- 2- yl)methyl]- 6- bromo- 4- nitrophenol
Smiles: Cc1ccc(o1)C(c1cc(cc(c1O)Br)[N+](=O)[O-])c1ccc(o1)C

STK527996
Synonyms: 1- [5- (bromomethyl)- 5- methyl- 4,5- dihydro- 1,3- thiazol- 2- yl]- 3- (3- chlorophenyl)- 1- (4- methylphenyl)urea
Smiles: BrCC1(C)CN=C(S1)N(C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)C

STK527997
Synonyms: ethyl2- [(6- ethoxy- 1,3- benzothiazol- 2- yl)amino]- 3,3,3- trifluoro- N- (pyridin- 3- ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)Nc1nc2c(s1)cc(cc2)OCC

STK527998
Synonyms: 8- methyl- 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]

STK527999
Synonyms: 2- [bis(5- methylfuran- 2- yl)methyl]- 4- bromo- 6- nitrophenol
Smiles: Brc1cc(C(c2ccc(o2)C)c2ccc(o2)C)c(c(c1)[N+](=O)[O-])O

STK528001
Synonyms: 8- methoxy- 3- ({(E)- [4- (pentyloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK528002
Synonyms: 1- [{[dimethyl(oxido)- lambda~6~- sulfanylidene]amino}(diphenyl)- lambda~5~- phosphanylidene]- 1- [(E)- phenyldiazenyl]propan- 2- one
Smiles: CC(=O)C(=P(c1ccccc1)(c1ccccc1)N=S(=O)(C)C)/N=N/c1ccccc1

STK528007
Synonyms: 4- [2- amino- 3- cyano- 4,4- bis(trifluoromethyl)- 5,6,7,8- tetrahydroquinolin- 1(4H)- yl]- N- (pyrimidin- 2- yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2ncccn2)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2

STK528008
Synonyms: (1,2,2- trimethylcyclopentane- 1,3- diyl)bis(morpholin- 4- ylmethanone)
Smiles: O=C(C1CCC(C1(C)C)(C)C(=O)N1CCOCC1)N1CCOCC1

STK528009
Synonyms: 2- (4- bromophenyl)- 1- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1CCN1CCCCC1)nc1c2cccc1

STK528011
Synonyms: methyl5- chloro- 3- {[(4- oxopiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=O)CC1)cc(cc2)Cl

STK528012
Synonyms: N- (2,2- dimethylpropanoyl)glycylnorvaline
Smiles: CCCC(C(=O)O)NC(=O)CNC(=O)C(C)(C)C

STK528013
Synonyms: 2- (azepan- 1- yl)- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)quinoxaline
Smiles: Cc1nn(c(c1)C)c1nc2ccccc2nc1N1CCCCCC1

STK528014
Synonyms: N- [2- (diethylamino)ethyl]- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCN(CCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)CC

STK528015
Synonyms: 4- [(E)- {2- [2- (2,4- dichlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]- 2- methylbenzene- 1,3- diol
Smiles: Clc1ccc(c(c1)Cl)c1nc(N/N=C/c2ccc(c(c2O)C)O)c2c(n1)cccc2

STK528016
Synonyms: 4- (isoquinolinium- 2- yl)- 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1)[n+]1ccc2c(c1)cccc2

STK528019
Synonyms: 5- [1- (phenylamino)ethylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CC(=C1C(=O)NC(=O)NC1=O)Nc1ccccc1

STK528021
Synonyms: ethyl5- fluoro- 3- {[(4- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C)cc(cc2)F

STK528022
Synonyms: 1- methyl- 2- tridecyl- 1H- imidazo[4,5- c]pyridine
Smiles: CCCCCCCCCCCCCc1nc2c(n1C)ccnc2

STK528023
Synonyms: 8- (heptylsulfanyl)- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK528027
Synonyms: 4- [(E)- {2- [2- (2- chlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]benzene- 1,3- diol
Smiles: Oc1ccc(c(c1)O)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK528029
Synonyms: 8- methyl- 4- (pyrrolidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC1

STK528031
Synonyms: 6,7- dimethoxy- 3- [(3- methoxyphenyl)amino]- 2- benzofuran- 1(3H)- one
Smiles: COc1cccc(c1)NC1OC(=O)c2c1ccc(c2OC)OC

STK528032
Synonyms: 7- benzyl- 8- (heptylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK528034
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1- (1H- indol- 3- yl)ethanol
Smiles: OC(c1c[nH]c2c1cccc2)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

STK528035
Synonyms: 1,4- diethyl- 3,6- bis(morpholin- 4- ylmethyl)tetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: CCN1C(=O)N(C2C1N(CN1CCOCC1)C(=O)N2CC)CN1CCOCC1

STK528036
Synonyms: methyl3- ({[4- (2- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cc(cc2)C

STK528037
Synonyms: 8- bromo- 3- (4- methoxybenzyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK528038
Synonyms: 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- tetrazole- 5- thiol
Smiles: Sc1nnnn1C12CC3CC(C2)CC(C1)C3

STK528039
Synonyms: (2E)- 2- [4- (heptyloxy)benzylidene]- N- [4- (2- methylpropoxy)benzyl]hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OCC(C)C

STK528040
Synonyms: 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1O)O

STK528041
Synonyms: 3,3'- ({3- [(2,4- dichlorophenoxy)methyl]- 4- methoxyphenyl}methanediyl)bis(4- hydroxy- 2H- chromen- 2- one)
Smiles: COc1ccc(cc1COc1ccc(cc1Cl)Cl)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2

STK528042
Synonyms: 8- {[(2Z)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SC/C=C(\Cl)/C)nc2c1c(=O)[nH]c(=O)n2C

STK528043
Synonyms: (2E)- 2- (4- ethoxybenzylidene)- 6,7- dimethyl[1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: CCOc1ccc(cc1)/C=c\1/sc2n(c1=O)c1c(n2)cc(c(c1)C)C

STK528046
Synonyms: 4- [2- amino- 3- cyano- 4,4- bis(trifluoromethyl)- 5,6,7,8- tetrahydroquinolin- 1(4H)- yl]- N- (4,6- dimethylpyrimidin- 2- yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2nc(C)cc(n2)C)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2

STK528047
Synonyms: 3- {[(E)- quinolin- 2- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(/N=C/c2ccc3c(n2)cccc3)cnc2c1[nH]c1c2cccc1

STK528050
Synonyms: 2- (4- chlorophenyl)- 4- [(2E)- 2- (2- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK528051
Synonyms: methyl3- ({[(3R)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK528052
Synonyms: diethyl1- (3,5- dimethoxybenzyl)- 2,5- dimethyl- 1H- pyrrole- 3,4- dicarboxylate
Smiles: CCOC(=O)c1c(C)n(c(c1C(=O)OCC)C)Cc1cc(OC)cc(c1)OC

STK528053
Synonyms: 8- methoxy- 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK528055
Synonyms: ethyl2- [4- ({[(2,4- dichlorophenyl)carbonyl]carbamothioyl}amino)- 3- methylphenyl]- 3,3,3- trifluoro- 2- hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(c(c1)C)NC(=S)NC(=O)c1ccc(cc1Cl)Cl)O

STK528056
Synonyms: 7- [(furan- 2- ylmethyl)amino]- 1- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2c3[nH]c4c(C)cccc4oc3cc(c2c(=O)c2c1cccc2)NCc1ccco1

STK528057
Synonyms: (2,2,2',2',4,4'- hexamethyl- 1,2,3,4- tetrahydro- 4,6'- biquinolin- 1'(2'H)- yl)(4- iodophenyl)methanone
Smiles: Ic1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2

STK528058
Synonyms: (2Z)- 1- (3- methoxyphenyl)- 3- [(2- nitrophenyl)amino]prop- 2- en- 1- one
Smiles: COc1cccc(c1)C(=O)/C=C\Nc1ccccc1[N+](=O)[O-]

STK528059
Synonyms: 2- (4- ethoxyphenyl)- 1- ethyl- 5,6- dihydrodipyrrolo[1,2- a:2',1'- c]pyrazine
Smiles: CCOc1ccc(cc1)c1cn2c(c1CC)c1cccn1CC2

STK528061
Synonyms: 4- {(2E)- 2- [1- (4- bromophenyl)ethylidene]hydrazinyl}- 2- (2- chlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C

STK528063
Synonyms: 7- [(2Z)- 3- chlorobut- 2- en- 1- yl]- 8- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C(=C/Cn1c(N/N=C(/c2ccc(cc2)Cl)\C)nc2c1c(=O)[nH]c(=O)n2C)/Cl

STK528064
Synonyms: 4- bromo- N- [(1Z)- 7- ethoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: CCOc1ccc2c(c1)NC(c1c2/c(=N/c2ccc(cc2)Br)/ss1)(C)C

STK528065
Synonyms: ethyl3- [(E)- pyrrolidin- 1- yldiazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCCC1)cccc2

STK528069
Synonyms: 5- bromo- 2- iodo- N- [2- methyl- 5- ([1,3]oxazolo[4,5- b]pyridin- 2- yl)phenyl]benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1cc(ccc1C)c1nc2c(o1)cccn2)I

STK528070
Synonyms: 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCC1=CCCCC1

STK528072
Synonyms: ethylN- (3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)- 3,3,3- trifluoro- 2- [(phenylcarbonyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCCC2)NC(=O)c1ccccc1

STK528073
Synonyms: 8- (dodecylsulfanyl)- 3- methyl- 7- (3- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C

STK528074
Synonyms: 2- chloro- N- (2,3- dimethylphenyl)- N- (2- ethoxyethyl)benzamide
Smiles: CCOCCN(c1cccc(c1C)C)C(=O)c1ccccc1Cl

STK528075
Synonyms: 4- {(2Z)- 5,7- dibromo- 2- [2- (4- nitrophenoxy)ethylidene]- 2,3- dihydro- 1- benzofuran- 3- yl}morpholine
Smiles: Brc1cc2C(N3CCOCC3)/C(=C/COc3ccc(cc3)[N+](=O)[O-])/Oc2c(c1)Br

STK528076
Synonyms: methyl2- (2,2'- bithiophen- 5- yl)quinoline- 4- carboxylate
Smiles: COC(=O)c1cc(nc2c1cccc2)c1ccc(s1)c1cccs1

STK528077
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 4- (4- methoxyphenyl)- 6- phenylpyridine- 3- carbonitrile
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SCC(=O)c1ccc(cc1)Br)c1ccccc1

STK528079
Synonyms: N- (4- chlorobenzyl)- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: Clc1ccc(cc1)CNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK528081
Synonyms: 4- (4- fluorophenoxy)- N- (furan- 2- ylmethyl)butan- 1- amine
Smiles: Fc1ccc(cc1)OCCCCNCc1ccco1

STK528082
Synonyms: 3- ({7- [(2E)- 3- chlorobut- 2- en- 1- yl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)propanoicacid
Smiles: OC(=O)CCSc1nc2c(n1C/C=C(/Cl)\C)c(=O)[nH]c(=O)n2C

STK528083
Synonyms: 8- chloro- 3- [2- (piperazin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCNCC1

STK528085
Synonyms: 2- [4- (2,3- dimethylphenyl)piperazin- 1- yl]- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1C)C

STK528087
Synonyms: methyl3- ({[4- (phenylcarbonyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccccc1)cccc2

STK528088
Synonyms: 2- (4- methoxyphenyl)- 1- [2- (4- methylpiperazin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: COc1ccc(cc1)c1cn2c(n1CCN1CCN(CC1)C)nc1c2cccc1

STK528091
Synonyms: 4- (3- methylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1)[n+]1cccc(c1)C

STK528092
Synonyms: 4- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 2- (4- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccc(cc2)Br)c2c(n1)cccc2

STK528093
Synonyms: 1- [6- (2,6- dimethoxyphenoxy)hexyl]- 4- methylpiperazine
Smiles: COc1cccc(c1OCCCCCCN1CCN(CC1)C)OC

STK528095
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 8- [(2Z)- 2- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(N/N=C/2\C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C

STK528096
Synonyms: N- [2- (diethylamino)ethyl]- N'- (1,3- thiazol- 2- yl)ethanediamide
Smiles: CCN(CCNC(=O)C(=O)Nc1nccs1)CC

STK528097
Synonyms: 2- (3,4- dichlorophenyl)- N- (2,5- dimethoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccc(c(c1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)OC

STK528101
Synonyms: 1- (pentabromobenzyl)piperidine
Smiles: Brc1c(CN2CCCCC2)c(Br)c(c(c1Br)Br)Br

STK528104
Synonyms: ethyl5- methoxy- 3- [(E)- pyrrolidin- 1- yldiazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCCC1)cc(cc2)OC

STK528105
Synonyms: diethyl{(4- methoxyphenyl)[(3- nitrophenyl)amino]methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1)OC)Nc1cccc(c1)[N+](=O)[O-])OCC

STK528109
Synonyms: 2- [(2,2- dimethoxyethyl)(methyl)amino]- 1- (1H- indol- 3- yl)ethanone
Smiles: COC(CN(CC(=O)c1c[nH]c2c1cccc2)C)OC

STK528111
Synonyms: 3- {[2- (cyclohex- 1- en- 1- yl)ethyl]amino}- 5- [(4- methoxyphenyl)amino]- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: COc1ccc(cc1)Nc1cc(NCCC2=CCCCC2)c2c3c1C(=O)c1ccccc1c3on2

STK528114
Synonyms: (5Z)- 1- (2- fluorophenyl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\NN1CCCCC1c1cccnc1)c1ccccc1F

STK528115
Synonyms: {1- [(1Z)- 3- (4- bromophenyl)- 3- oxo- 1- phenylprop- 1- en- 2- yl]pyridin- 2(1H)- ylidene}propanedinitrile
Smiles: N#CC(=c1ccccn1/C(=C\c1ccccc1)/C(=O)c1ccc(cc1)Br)C#N

STK528117
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (2- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK528120
Synonyms: ethyl(2- {[(4- hydroxy- 2- oxo- 1- propyl- 1,2- dihydroquinolin- 3- yl)carbonyl]amino}- 1,3- thiazol- 4- yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)c1c(O)c2ccccc2n(c1=O)CCC

STK528121
Synonyms: 2- (4- chlorophenyl)- N- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2ccc(cc2Cl)Cl)c2c(n1)cccc2

STK528123
Synonyms: 3- {[(1E)- 3- (4- tert- butylphenyl)- 2- methylpropylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/C(Cc1ccc(cc1)C(C)(C)C)C

STK528124
Synonyms: N- {2- [(3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}pyridine- 3- carboxamide
Smiles: N#Cc1c(sc2c1CCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1

STK528125
Synonyms: 4- [(E)- (4- hydroxy- 3- {[(triethylstannanyl)oxy]carbonyl}phenyl)diazenyl]- N- (pyridin- 2- yl)benzenesulfonamide
Smiles: CC[Sn](OC(=O)c1cc(/N=N/c2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O)(CC)CC

STK528127
Synonyms: 1,5- bis(4- methoxyphenyl)- 3- phenylpentane- 1,5- dione
Smiles: COc1ccc(cc1)C(=O)CC(c1ccccc1)CC(=O)c1ccc(cc1)OC

STK528128
Synonyms: 3- methyl- 8- (nonylsulfanyl)- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(SCCCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK528129
Synonyms: 3- methyl- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STK528130
Synonyms: N- {2- [(3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}pyridine- 4- carboxamide
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccncc1

STK528131
Synonyms: 2- (pentachlorophenyl)- 4,5- diphenyl- 1H- imidazole
Smiles: Clc1c(Cl)c(c2nc(c([nH]2)c2ccccc2)c2ccccc2)c(c(c1Cl)Cl)Cl

STK528132
Synonyms: 3,4- dimethyl- N- [(1Z)- 4,4,6- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: Cc1cc(ccc1C)/N=c/1\ssc2c1c1cccc(c1NC2(C)C)C

STK528135
Synonyms: methyl3- {[3- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(cc2)C

STK528136
Synonyms: 10- [2- hydroxy- 3- (piperidin- 1- yl)propyl]acridin- 9(10H)- one
Smiles: OC(Cn1c2ccccc2c(=O)c2c1cccc2)CN1CCCCC1

STK528137
Synonyms: 4- (azepan- 1- yl)- 2- (2,4- dichlorophenyl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(N2CCCCCC2)c2c(n1)cccc2

STK528138
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1- (1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: O=C(c1c(C)n(c2c1cccc2)C)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

STK528139
Synonyms: 2- {2- oxo- 2- [(triethylstannanyl)oxy]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CC[Sn](OC(=O)CN1C(=O)c2c(C1=O)cccc2)(CC)CC

STK528140
Synonyms: 1- (diphenylmethyl)- 4- {2- [2- (4- fluorophenoxy)ethoxy]ethyl}piperazine
Smiles: Fc1ccc(cc1)OCCOCCN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK528142
Synonyms: 7- [(furan- 2- ylmethyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2c3[nH]c4ccccc4oc3cc(c2c(=O)c2c1cccc2)NCc1ccco1

STK528144
Synonyms: N- [(1E)- 1- (3,4- dimethoxyphenyl)- 3- {(2E)- 2- [1- (4- fluorophenyl)ethylidene]hydrazinyl}- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: COc1ccc(cc1OC)/C=C(\C(=O)N/N=C(/c1ccc(cc1)F)\C)/NC(=O)c1ccccc1

STK528146
Synonyms: 3- (4- chlorophenyl)- 1- (5- methyl- 4,5- dihydro- 1,3- thiazol- 2- yl)- 1- (2- phenylethyl)urea
Smiles: CC1CN=C(S1)N(C(=O)Nc1ccc(cc1)Cl)CCc1ccccc1

STK528152
Synonyms: 4,4'- {[4- (dimethylamino)phenyl](hydroxy)methanediyl}bis(1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one)
Smiles: CN(c1ccc(cc1)C(c1c(C)n(n(c1=O)c1ccccc1)C)(c1c(C)n(n(c1=O)c1ccccc1)C)O)C

STK528153
Synonyms: N- [(4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 3- yl)carbamothioyl]benzamide
Smiles: S=C(Nn1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1)NC(=O)c1ccccc1

STK528154
Synonyms: 6- [(2- amino- 2- oxo- 1- phenylethyl)sulfanyl]- 5- cyano- 4- (3,4- dimethoxyphenyl)- N- (2- methoxyphenyl)- 2- methylpyridine- 3- carboxamide
Smiles: N#Cc1c(nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1OC)C)SC(c1ccccc1)C(=O)N

STK528155
Synonyms: 7- heptyl- 8- hydrazinyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(NN)nc2c1c(=O)[nH]c(=O)n2C

STK528156
Synonyms: biphenyl- 2- yl(4,4,6- trimethyl- 1- thioxo- 1,4- dihydro- 5H- [1,2]dithiolo[3,4- c]quinolin- 5- yl)methanone
Smiles: O=C(N1c2c(C)cccc2c2c(C1(C)C)ssc2=S)c1ccccc1c1ccccc1

STK528157
Synonyms: 2- (2,4- dichlorophenyl)- N- (3- fluorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2cccc(c2)F)c2c(n1)cccc2

STK528158
Synonyms: 1- methyl- 7- [(4- methylphenyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc(cc1)Nc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK528159
Synonyms: 6- hydroxy- 3,4- dihydro- 2H,8H- pyrimido[2,1- b][1,3]thiazin- 8- one
Smiles: O=c1cc(O)n2c(n1)SCCC2

STK528160
Synonyms: 1,7- dibenzyl- 3- methyl- 8- (propan- 2- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Sc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)C

STK528164
Synonyms: N- (2- chloropyridin- 3- yl)- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1cccnc1Cl

STK528166
Synonyms: 2- {[(E)- (5- iodofuran- 2- yl)methylidene]amino}- 4,5- diphenylfuran- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(o2)I)oc(c1c1ccccc1)c1ccccc1

STK528168
Synonyms: 3- methyl- 8- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STK528170
Synonyms: methyl5- bromo- 3- [({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}acetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)Br

STK528172
Synonyms: 4- hydroxy- N- (2- hydroxyethyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: OCCNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK528173
Synonyms: ethyl3- [({1- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 3,4- dihydroisoquinolin- 2(1H)- yl}acetyl)amino]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)OC

STK528175
Synonyms: 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528176
Synonyms: 1,1'- (3,9- dimethyldipyrrolo[1,2- a:2',1'- c]pyrazine- 1,8- diyl)bis(trifluoroethanone)
Smiles: Cc1cc(c2n1ccn1c2cc(c1C(=O)C(F)(F)F)C)C(=O)C(F)(F)F

STK528177
Synonyms: 1- ethyl- 6- fluoro- N- (3- methylbutyl)- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCCC(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK528179
Synonyms: 2- (2,4- dichlorophenyl)- N- [3- (trifluoromethyl)phenyl]quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2cccc(c2)C(F)(F)F)c2c(n1)cccc2

STK528181
Synonyms: (4- chlorophenyl)(2,2,2',2',4,4'- hexamethyl- 1,2,3,4- tetrahydro- 4,6'- biquinolin- 1'(2'H)- yl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2

STK528182
Synonyms: N- (diphenylacetyl)- beta- alanine
Smiles: O=C(C(c1ccccc1)c1ccccc1)NCCC(=O)O

STK528183
Synonyms: 3- {[(triethylstannanyl)oxy]carbonyl}pyridine
Smiles: CC[Sn](OC(=O)c1cccnc1)(CC)CC

STK528184
Synonyms: 8- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C

STK528185
Synonyms: 8- methoxy- 3- {[(E)- (4- methoxy- 3- {[4- (2- methoxyphenyl)piperazin- 1- yl]methyl}phenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)CN1CCN(CC1)c1ccccc1OC)OC

STK528186
Synonyms: 5,5'- sulfanediylbis(1- methyl- 4- nitro- 1H- imidazole)
Smiles: Cn1cnc(c1Sc1n(C)cnc1[N+](=O)[O-])[N+](=O)[O-]

STK528190
Synonyms: 3- [2- (diethylamino)ethyl]- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCN(CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)OC)CC

STK528191
Synonyms: 4- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nc2ccccc2n2c1nnc2

STK528193
Synonyms: N- (4- methoxybenzyl)- 8- methyl- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1ccc(cc1)CNc1ncnc2c1[nH]c1c2cc(cc1)C

STK528194
Synonyms: 3- {[(E)- (3- hydroxy- 4- methoxyphenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)O)OC

STK528197
Synonyms: (2E)- 2- [4- (2,4- dichlorophenyl)- 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(cc1Cl)Cl

STK528200
Synonyms: 1,7- dibenzyl- 8- [(2E)- 2- (5- bromo- 2- hydroxybenzylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1ccc(c(c1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)O

STK528201
Synonyms: 8- bromo- 3- {[(E)- (3- iodophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)I

STK528202
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- {[4- (propan- 2- yl)phenyl]amino}prop- 2- enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)C(C)C)/C#N

STK528203
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528207
Synonyms: 7- methyl- 7- (morpholin- 4- yl)- 4,5,7,8- tetrahydro- 8aH- [1,2,5]oxadiazolo[3,4- e]indol- 8a- ol6- oxide
Smiles: [O-][N+]1=C2CCc3c(C2(CC1(C)N1CCOCC1)O)non3

STK528208
Synonyms: 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c2cc(OC)ccc2n(c1C)C

STK528209
Synonyms: 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528210
Synonyms: hexa- 2,4- diyne- 1,6- diylbis(4- nitrobenzoate)
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCC#CC#CCOC(=O)c1ccc(cc1)[N+](=O)[O-]

STK528211
Synonyms: [3- amino- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl](3- methylphenyl)methanone
Smiles: Cc1cccc(c1)C(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1

STK528212
Synonyms: 4- (4- ethylpyridinium- 1- yl)- 5- formyl- 2- oxo- 1,3- thiazol- 3- ide
Smiles: CCc1cc[n+](cc1)c1[n-]c(=O)sc1C=O

STK528213
Synonyms: 2- [2- (3,4- dimethoxyphenyl)ethyl]- N,N- diethyl- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinoline- 6- carboxamide
Smiles: COc1cc(ccc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3C(=O)N(CC)CC

STK528215
Synonyms: 4- (4- fluorophenoxy)- N- (tetrahydrofuran- 2- ylmethyl)butan- 1- amine
Smiles: Fc1ccc(cc1)OCCCCNCC1CCCO1

STK528216
Synonyms: 3,7- dimethyl- 8- (nonylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK528217
Synonyms: 2- [(1E)- 1- {2- [2- (3,4- dichlorophenyl)quinazolin- 4- yl]hydrazinylidene}ethyl]phenol
Smiles: Oc1ccccc1/C(=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)/C

STK528218
Synonyms: ethyl5'- {[(phenylsulfanyl)acetyl]amino}- 2,3'- bithiophene- 4'- carboxylate
Smiles: CCOC(=O)c1c(scc1c1cccs1)NC(=O)CSc1ccccc1

STK528219
Synonyms: 1- (3- chloro- 9,10- dioxo- 9,10- dihydroanthracen- 2- yl)- 3- naphthalen- 1- ylurea
Smiles: O=C(Nc1cccc2c1cccc2)Nc1cc2c(cc1Cl)C(=O)c1c(C2=O)cccc1

STK528220
Synonyms: 3,4,5,6- tetrachloro- N- {2- [4- phenyl- 2- (propan- 2- yl)tetrahydro- 2H- pyran- 4- yl]ethyl}pyridine- 2- carboxamide
Smiles: CC(C1OCCC(C1)(CCNC(=O)c1nc(Cl)c(c(c1Cl)Cl)Cl)c1ccccc1)C

STK528223
Synonyms: 2- (4- chlorophenyl)- 4- [(2E)- 2- (2- fluorobenzylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2F)c2c(n1)cccc2

STK528224
Synonyms: 4- (3,5- dimethylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: Cc1cc(C)c[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1

STK528225
Synonyms: butyl4- (1H- naphtho[1,2- e][1,3]oxazin- 2(3H)- yl)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1COc2c(C1)c1ccccc1cc2

STK528226
Synonyms: methyl3- ({3- [4- (4- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)cc(cc2)C

STK528228
Synonyms: methyl3- ({[3- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK528229
Synonyms: 2- bromo- 6- {(E)- [2- (4- methoxyphenyl)hydrazinylidene]methyl}phenol
Smiles: COc1ccc(cc1)N/N=C/c1cccc(c1O)Br

STK528230
Synonyms: methyl5- chloro- 3- {[(4- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C)cc(cc2)Cl

STK528231
Synonyms: 7,7'- piperazine- 1,4- diylbis(N,N- diethyl- 4- nitro- 2,1,3- benzoxadiazol- 5- amine)
Smiles: CCN(c1cc(N2CCN(CC2)c2cc(N(CC)CC)c(c3c2non3)[N+](=O)[O-])c2c(c1[N+](=O)[O-])non2)CC

STK528232
Synonyms: 2- methoxy- 4- [(E)- {2- [(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]hydrazinylidene}methyl]phenylnaphthalene- 1- carboxylate
Smiles: COc1cc(/C=N/NC(=O)c2c(C)onc2c2ccccc2)ccc1OC(=O)c1cccc2c1cccc2

STK528233
Synonyms: 1- {1- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]cyclopentyl}- 4- nitrosopiperazine
Smiles: O=NN1CCN(CC1)C1(CCCC1)c1nnnn1c1c(C)cccc1C

STK528235
Synonyms: 1- [4- (naphthalen- 1- yloxy)butyl]- 4- [3- (trifluoromethyl)phenyl]piperazine
Smiles: FC(c1cccc(c1)N1CCN(CC1)CCCCOc1cccc2c1cccc2)(F)F

STK528236
Synonyms: 8- chloro- 1- (2- chloroethyl)- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: ClCCn1c(=O)n(C)c2c(c1=O)n(C)c(n2)Cl

STK528238
Synonyms: 6- {(E)- [2- (4- hydroxyphenyl)hydrazinylidene]methyl}- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/Nc1ccc(cc1)O

STK528239
Synonyms: 6- bromo- 1- {(E)- [(5- chloropyridin- 2- yl)imino]methyl}naphthalen- 2- ol
Smiles: Clc1ccc(nc1)/N=C/c1c(O)ccc2c1ccc(c2)Br

STK528240
Synonyms: 8- (benzylsulfanyl)- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK528242
Synonyms: 6- {[2- (3- bromophenyl)- 2- oxoethyl]sulfanyl}- 5- cyano- 4- (furan- 2- yl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)c2cccc(c2)Br)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK528243
Synonyms: 1- (4- methoxybenzyl)- 3,7- dimethyl- 8- (4- methylpiperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)N1CCC(CC1)C

STK528245
Synonyms: ethyl2- [(3- chloro- 2- methylphenyl)amino]- N- [(2- chlorophenyl)carbonyl]- 3,3,3- trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1cccc(c1C)Cl)NC(=O)c1ccccc1Cl

STK528247
Synonyms: 7- hexadecyl- 3- methyl- 8- [(3- phenylpropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK528248
Synonyms: 6,7,8,9,9a,10,11,12,13,14- decahydro- 2H- benzimidazo[2,1- e]acridin- 2- ylidenepropanedinitrile
Smiles: N#CC(=c1ccc2=NC34N(c2c1)C1=C(CCCC1)CC4CCCC3)C#N

STK528255
Synonyms: 8- methyl- 4- (thiomorpholin- 4- yl)- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCSCC1

STK528256
Synonyms: 2- (3,4- dichlorophenyl)- N- [3- (trifluoromethyl)phenyl]quinazolin- 4- amine
Smiles: Clc1ccc(cc1Cl)c1nc(Nc2cccc(c2)C(F)(F)F)c2c(n1)cccc2

STK528257
Synonyms: N- benzyl- 4,6- dimethyl- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)NCc1ccccc1

STK528258
Synonyms: 4- [(E)- {2- [2- (2,4- dichlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]- 2- methoxyphenol
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2Cl)Cl)ccc1O

STK528259
Synonyms: 4- (azepan- 1- yl)- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCCCC1

STK528261
Synonyms: {4- [2- (4- fluorophenoxy)ethyl]piperazin- 1- yl}(furan- 2- yl)methanone
Smiles: Fc1ccc(cc1)OCCN1CCN(CC1)C(=O)c1ccco1

STK528262
Synonyms: N- (4- bromophenyl)- 2- (2- chlorophenyl)quinazolin- 4- amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK528264
Synonyms: 3- [4- (dimethylamino)benzyl]- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)N(C)C

STK528265
Synonyms: N- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]- N'- undecylethanediamide
Smiles: CCCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK528266
Synonyms: 4- (4- methoxyphenyl)- 2- [2- (propan- 2- yl)tetrahydro- 2H- pyran- 4- yl]- 1,3- thiazole
Smiles: COc1ccc(cc1)c1csc(n1)C1CCOC(C1)C(C)C

STK528267
Synonyms: 4- ethyl- 2- (4- methoxyphenyl)- 5,5- dimethyl- 2,5- dihydro- 1H- imidazol- 1- ol
Smiles: CCC1=NC(N(C1(C)C)O)c1ccc(cc1)OC

STK528269
Synonyms: 2- phenyl- 4- {[(tricyclohexylstannanyl)oxy]carbonyl}quinoline
Smiles: O=C(c1cc(nc2c1cccc2)c1ccccc1)O[Sn](C1CCCCC1)(C1CCCCC1)C1CCCCC1

STK528270
Synonyms: 2- (2,4- dichlorophenyl)- 4- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]quinazoline
Smiles: Fc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528271
Synonyms: (7Z)- N- (4- methylphenyl)- 7- [(4- methylphenyl)imino]cyclohepta- 1,3,5- trien- 1- amine
Smiles: Cc1ccc(cc1)Nc1ccccc/c/1=N/c1ccc(cc1)C

STK528273
Synonyms: 3- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cc(Br)ccc1O

STK528274
Synonyms: 2,2- dimethyl- 3- phenyl- 7- (1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)hept- 5- yn- 3- ol
Smiles: CC12CC(N(C1)CC#CCC(C(C)(C)C)(c1ccccc1)O)CC(C2)(C)C

STK528275
Synonyms: 5- cyano- 4- (furan- 2- yl)- 2- methyl- 6- [(2- methylbenzyl)sulfanyl]- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCc2ccccc2C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK528276
Synonyms: ethyl3- [(E)- (4- benzylpiperidin- 1- yl)diazenyl]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCC(CC1)Cc1ccccc1)cc(cc2)OC

STK528277
Synonyms: 8- (dodecylsulfanyl)- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK528279
Synonyms: ethyl3,3- dicyano- 2- oxo- 4- phenyl- 2,3,4,4a,5,6,7,8- octahydronaphthalene- 1- carboxylate
Smiles: CCOC(=O)C1=C2CCCCC2C(C(C1=O)(C#N)C#N)c1ccccc1

STK528280
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 1- (1H- indol- 3- yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK528282
Synonyms: 3- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528283
Synonyms: 8,8'- (ethane- 1,2- diyldisulfanediyl)bis(3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione)
Smiles: Cn1c(SCCSc2nc3c(n2C)c(=O)[nH]c(=O)n3C)nc2c1c(=O)[nH]c(=O)n2C

STK528285
Synonyms: 8- (diphenylmethoxy)- 7- (3- methoxybenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1cccc(c1)Cn1c(OC(c2ccccc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK528286
Synonyms: 2- chloro- 3- {[3- (1H- imidazol- 1- yl)propyl]amino}naphthalene- 1,4- dione
Smiles: ClC1=C(NCCCn2cncc2)C(=O)c2c(C1=O)cccc2

STK528287
Synonyms: 3,4- dichloro- N- [(1Z)- 8- methoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: COc1ccc2c(c1)c1/c(=N/c3ccc(c(c3)Cl)Cl)/ssc1C(N2)(C)C

STK528289
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [2- (pyridin- 3- yl)- 1H- benzimidazol- 1- yl]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)Cn1c(nc2c1cccc2)c1cccnc1

STK528292
Synonyms: 7- decyl- 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK528293
Synonyms: 8- methoxy- 3- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cc(OC)c(c(c1)OC)OC

STK528294
Synonyms: N- [(3Z)- 5- (methylsulfanyl)- 3H- 1,2,4- dithiazol- 3- ylidene]acetamide
Smiles: CSc1ss/c(=N\C(=O)C)/n1

STK528295
Synonyms: 1- [(3,5- di- tert- butyl- 4- hydroxyphenyl)(morpholin- 4- yl)methyl]naphthalen- 2- ol
Smiles: Oc1ccc2c(c1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N1CCOCC1)cccc2

STK528296
Synonyms: 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK528298
Synonyms: 2,3- dimethoxy- 6- {(E)- [2- ({[(3,4,5- trimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}benzoicacid(non- preferredname)
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)CNC(=O)c1cc(OC)c(c(c1)OC)OC

STK528299
Synonyms: 4- [(8- methoxy- 4- oxo- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- yl)methyl]benzonitrile
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)C#N

STK528301
Synonyms: methyl3- {[(4- benzylpiperazin- 1- yl)acetyl]amino}- 5- bromo- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)Br

STK528302
Synonyms: methyl3- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK528303
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1ccccc1F

STK528304
Synonyms: 2- (2- chlorophenyl)- N- (2- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1ccccc1Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK528306
Synonyms: 7- [(2E)- but- 2- en- 1- yl]- 3- methyl- 8- [(2E)- 2- (1- phenylethylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C=C/Cn1c(N/N=C(/c2ccccc2)\C)nc2c1c(=O)[nH]c(=O)n2C

STK528309
Synonyms: 2- (4- chlorophenyl)- 2- oxoethyl2,6- dimethylmorpholine- 4- carbodithioate
Smiles: CC1OC(C)CN(C1)C(=S)SCC(=O)c1ccc(cc1)Cl

STK528310
Synonyms: 2- {[2- oxo- 2- (thiophen- 2- yl)ethyl]sulfanyl}- 4- (pyridin- 4- yl)- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2cccs2)nc2c(c1c1ccncc1)CCCC2

STK528312
Synonyms: methyl3- {[(4- carbamoylpiperidin- 1- yl)acetyl]amino}- 5- chloro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CC[C@H](CC1)C(=O)N)cc(cc2)Cl

STK528313
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- N- (1,3,4- thiadiazol- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2nncs2)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK528315
Synonyms: 3- [2- (4- chlorophenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]- N,N- diethylpropan- 1- amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Cl)CC

STK528316
Synonyms: 2- (2,4- dichlorophenyl)- N- (3,4- dimethylphenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2ccc(c(c2)C)C)c2c(n1)cccc2

STK528317
Synonyms: 2- (4- methoxyphenyl)- 1- [3- (pyrrolidin- 1- yl)propyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: COc1ccc(cc1)c1cn2c(n1CCCN1CCCC1)nc1c2cccc1

STK528319
Synonyms: 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cccc(c1O)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK528320
Synonyms: 3- [4- (dimethylamino)phenyl]- 1,5- di(naphthalen- 2- yl)pentane- 1,5- dione
Smiles: O=C(c1ccc2c(c1)cccc2)CC(c1ccc(cc1)N(C)C)CC(=O)c1ccc2c(c1)cccc2

STK528321
Synonyms: 7- heptyl- 3- methyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(S)nc2c1c(=O)[nH]c(=O)n2C

STK528323
Synonyms: 3,3,3- trifluoro- N- {1,1,1,3,3,3- hexafluoro- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)amino]propan- 2- yl}- 2- (trifluoromethyl)propanamide
Smiles: O=C(C(C(F)(F)F)C(F)(F)F)NC(C(F)(F)F)(C(F)(F)F)Nc1nnc(s1)C

STK528325
Synonyms: 3- ({7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 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)COc1ccccc1C

STK528327
Synonyms: ethyl4- (heptylamino)- 2- oxo- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC

STK528329
Synonyms: 6- bromo- 3- [4- (9H- fluoren- 2- yl)- 1,3- thiazol- 2- yl]- 2H- chromen- 2- one
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc2c(c1)Cc1c2cccc1

STK528331
Synonyms: 3- (1,1- dioxido- 2H- 1,2,4- benzothiadiazin- 3- yl)- 1- heptyl- 4- hydroxyquinolin- 2(1H)- one
Smiles: CCCCCCCn1c(=O)c(C2=Nc3ccccc3S(=O)(=O)N2)c(c2c1cccc2)O

STK528332
Synonyms: 3- heptyl- 1- methyl- 6,7- dihydro[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCCCn1c(=O)c2n3CCSc3nc2n(c1=O)C

STK528333
Synonyms: 5- (dimethylsulfonio)- 1- (4- ethoxyphenyl)- 2,4,6- trioxohexahydropyrimidin- 5- ide
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)[C-](C1=O)[S+](C)C

STK528334
Synonyms: 2- ethyl- N- [(1Z)- 4,4,8- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1cc(C)ccc1NC2(C)C

STK528335
Synonyms: 1- [4- (4- fluorophenoxy)butyl]- 4- (2- methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCOc1ccc(cc1)F

STK528337
Synonyms: 2- (3,4- dichlorophenyl)- 4- methoxyquinazoline
Smiles: COc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528338
Synonyms: N- [(4Z)- 7,7- dimethyl- 2- (methylsulfanyl)- 1- phenyl- 8- oxa- 1,3- diazaspiro[4.5]dec- 2- en- 4- ylidene]- 2,6- dimethylaniline
Smiles: CSC1=N/C(=N\c2c(C)cccc2C)/C2(N1c1ccccc1)CCOC(C2)(C)C

STK528341
Synonyms: 1,7- dibenzyl- 8- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)/C

STK528342
Synonyms: decyl(2E)- 3- [5- (4- bromophenyl)furan- 2- yl]- 2- cyanoprop- 2- enoate
Smiles: CCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N

STK528344
Synonyms: 3- {[2- (cyclohex- 1- en- 1- yl)ethyl]amino}- 5- (phenylamino)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)NCCC1=CCCCC1

STK528346
Synonyms: methyl5- bromo- 3- ({[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)cc(cc2)Br

STK528347
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cc(ccc1O)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK528350
Synonyms: (2E)- 2- [4- (6- bromo- 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(Br)ccc2oc1=O

STK528352
Synonyms: propyl4- ({[(1,3- benzodioxol- 5- ylmethyl)amino](oxo)acetyl}amino)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)NC(=O)C(=O)NCc1ccc2c(c1)OCO2

STK528353
Synonyms: methyl3- {[(4- benzylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cccc2

STK528354
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- (nonylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK528355
Synonyms: 7- heptyl- 3- methyl- 8- (prop- 2- en- 1- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(SCC=C)nc2c1c(=O)[nH]c(=O)n2C

STK528358
Synonyms: N'- [(1E)- 1- (6- bromo- 2- oxo- 2H- chromen- 3- yl)ethylidene]benzohydrazide
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccccc1)/C

STK528359
Synonyms: (2E)- 4- ({3- chloro- 4- [(phenylcarbonyl)amino]phenyl}amino)- 4- oxobut- 2- enoicacid
Smiles: OC(=O)/C=C/C(=O)Nc1ccc(c(c1)Cl)NC(=O)c1ccccc1

STK528362
Synonyms: 2- (2,4- dichlorophenyl)- N- (2- fluorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2ccccc2F)c2c(n1)cccc2

STK528363
Synonyms: 8- bromo- 3- {[(E)- (2- hydroxy- 5- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(c(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br)O

STK528364
Synonyms: 3- {[(E)- pyridin- 4- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(/N=C/c2ccncc2)cnc2c1[nH]c1c2cccc1

STK528365
Synonyms: 4,4'- {(2- hydroxy- 5- methylbenzene- 1,3- diyl)bis[(E)methylylidenenitrilo]}bis(2,5- dimethyl- 1- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one)
Smiles: Cc1cc(/C=N/c2c(C)n(n(c2=O)C)c2ccccc2)c(c(c1)/C=N/c1c(C)n(n(c1=O)C)c1ccccc1)O

STK528366
Synonyms: 2- oxo- 4- [4- (phenylcarbonyl)pyridinium- 1- yl]- 5- {(E)- [2- (pyridin- 3- ylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)C(=O)c1ccccc1)/C=N/NC(=O)c1cccnc1

STK528369
Synonyms: 8- (decylsulfanyl)- 3- methyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK528370
Synonyms: 8- (azepan- 1- yl)- 7- (3- bromobenzyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCCC1

STK528371
Synonyms: 9H- benzo[5,6]chromeno[2,3- d][1,3]thiazole- 9- thione
Smiles: S=c1nc2c(s1)cc1c(o2)ccc2c1cccc2

STK528372
Synonyms: 2- (2,4- dichlorophenyl)- 4- [(2E)- 2- (1- phenylethylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(N/N=C(/c2ccccc2)\C)c2c(n1)cccc2

STK528373
Synonyms: 6- hexyl- 7- hydroxy- 3- {4- [4- (phenylsulfanyl)phenyl]- 1,3- thiazol- 2- yl}- 2H- chromen- 2- one
Smiles: CCCCCCc1cc2cc(c3scc(n3)c3ccc(cc3)Sc3ccccc3)c(=O)oc2cc1O

STK528374
Synonyms: 8- bromo- 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1F

STK528375
Synonyms: 2- ethyl- N'- [(E)- quinolin- 2- ylmethylidene]quinoline- 4- carbohydrazide
Smiles: CCc1nc2ccccc2c(c1)C(=O)N/N=C/c1ccc2c(n1)cccc2

STK528378
Synonyms: 7- {4- methoxy- 3- [(4- nitrophenoxy)methyl]phenyl}- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: COc1ccc(cc1COc1ccc(cc1)[N+](=O)[O-])C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK528379
Synonyms: (5E)- 1- benzyl- 5- (2,4- dimethoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(c(c1)OC)/C=C/1\C(=O)NC(=O)N(C1=O)Cc1ccccc1

STK528380
Synonyms: 7- (3- bromobenzyl)- 8- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C

STK528381
Synonyms: methyl3- {[N- (2,2- dimethoxyethyl)- N- methylglycyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(CN(CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC)C)OC

STK528382
Synonyms: 2- chloro- 1- (3- methyl- 1H- indol- 2- yl)ethanone
Smiles: ClCC(=O)c1[nH]c2c(c1C)cccc2

STK528383
Synonyms: dimethyl5,5'- {oxybis[benzene- 4,1- diylnitrilo(E)methylylidene]}bis(2- methyl- 4- phenyl- 1H- pyrrole- 3- carboxylate)
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccccc1)/C=N/c1ccc(cc1)Oc1ccc(cc1)/N=C/c1[nH]c(c(c1c1ccccc1)C(=O)OC)C

STK528384
Synonyms: 4- [(E)- phenyldiazenyl]- N- [(E)- pyridin- 4- ylmethylidene]aniline
Smiles: n1ccc(cc1)/C=N/c1ccc(cc1)/N=N/c1ccccc1

STK528385
Synonyms: 2- {[(1Z)- 8- ethoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]amino}- 4- methylphenol
Smiles: CCOc1ccc2c(c1)c1/c(=N/c3cc(C)ccc3O)/ssc1C(N2)(C)C

STK528386
Synonyms: butyl({7- [(2E)- 3- chlorobut- 2- en- 1- yl]- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}sulfanyl)acetate
Smiles: CCCCOC(=O)CSc1nc2c(n1C/C=C(/Cl)\C)c(=O)[nH]c(=O)n2C

STK528388
Synonyms: 2- (biphenyl- 4- yl)- 4- (4- chlorophenyl)- 5- phenyl- 1H- imidazole
Smiles: Clc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1ccc(cc1)c1ccccc1

STK528390
Synonyms: 6- {(E)- [2- ({[(3,4- dimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}- 2,3- dimethoxybenzoicacid(non- preferredname)
Smiles: COc1ccc(cc1OC)C(=O)NCC(=O)N/N=C/c1ccc(c(c1C(=O)O)OC)OC

STK528392
Synonyms: 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK528394
Synonyms: 3- decyl- 1- methyl- 6,7- dihydro[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCCCCCCn1c(=O)c2n3CCSc3nc2n(c1=O)C

STK528395
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- heptyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK528396
Synonyms: 2- {6- oxo- 6- [(tributylstannanyl)oxy]hexyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CCCC[Sn](OC(=O)CCCCCN1C(=O)c2c(C1=O)cccc2)(CCCC)CCCC

STK528397
Synonyms: [5,10,15,20- tetra(pyridin- 3- yl)porphyrinato(2- )- kappa~2~N~21~,N~23~]copper
Smiles: c1ccc(cn1)C1=C2C=CC(=N2)C(=c2n3[Cu]n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1cccnc1)c1cccnc1)c1cccnc1

STK528398
Synonyms: 2- (dimethylamino)ethyltricyclo[3.3.1.1~3,7~]dec- 1- ylcarbamate
Smiles: CN(CCOC(=O)NC12CC3CC(C2)CC(C1)C3)C

STK528401
Synonyms: 1- {(E)- [(5- bromopyridin- 2- yl)imino]methyl}- 6- nitronaphthalen- 2- ol
Smiles: Brc1ccc(nc1)/N=C/c1c(O)ccc2c1ccc(c2)[N+](=O)[O-]

STK528402
Synonyms: N,N- dibutyl- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCN(C(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)CCCC

STK528403
Synonyms: methyl5- [(E)- (2- carbamothioylhydrazinylidene)methyl]- 2- methyl- 4- phenyl- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccccc1)/C=N/NC(=S)N

STK528405
Synonyms: 3- (chloromethyl)- 1,3- benzoxazol- 2(3H)- one
Smiles: ClCn1c(=O)oc2c1cccc2

STK528407
Synonyms: 4- (biphenyl- 4- yloxy)- 2- (4- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2

STK528408
Synonyms: 2- (2,4- dichlorophenyl)- 4- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2Cl)Cl)ccc1OC

STK528409
Synonyms: 3- {[(E)- 1,3- benzodioxol- 5- ylmethylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc2c(c1)OCO2

STK528411
Synonyms: N'- (5- nitro- 4,6- dioxotetrahydropyrimidin- 2(1H)- ylidene)- 2- (thiophen- 2- yl)quinoline- 4- carbohydrazide
Smiles: O=C1N/C(=N/NC(=O)c2cc(nc3c2cccc3)c2cccs2)/NC(=O)C1[N+](=O)[O-]

STK528412
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(4- ethoxyphenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(\c1scc(n1)c1cc2cc(Br)ccc2oc1=O)/C#N

STK528413
Synonyms: 8- (hexylsulfanyl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK528415
Synonyms: 2- (4- chlorophenyl)- N- (4- methoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK528416
Synonyms: 6- methyl- 1- nitroso- 1,2,3,4- tetrahydroquinoline
Smiles: O=NN1CCCc2c1ccc(c2)C

STK528417
Synonyms: 3- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528419
Synonyms: 3- [2- (dimethylamino)ethyl]- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CN(CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)C)C

STK528421
Synonyms: N'- (4- hydroxybutanoyl)tricyclo[3.3.1.1~3,7~]decane- 1- carbohydrazide
Smiles: OCCCC(=O)NNC(=O)C12CC3CC(C2)CC(C1)C3

STK528422
Synonyms: 3- {[(E)- (3- chlorophenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)Cl

STK528423
Synonyms: 8- (azepan- 1- yl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCCC1

STK528424
Synonyms: 7- hexadecyl- 3- methyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1

STK528426
Synonyms: 4- chloro- N- [dimethyl(oxido)- lambda~6~- sulfanylidene]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N=S(=O)(C)C

STK528427
Synonyms: N- [2- (2- phenyl- 1H- imidazo[1,2- a]benzimidazol- 1- yl)ethyl]cyclohexanamine
Smiles: C1CCC(CC1)NCCn1c(cn2c1nc1c2cccc1)c1ccccc1

STK528428
Synonyms: 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK528429
Synonyms: methyl5- chloro- 3- {[(4- ethylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK528430
Synonyms: N- [(E)- (4- nitrophenyl)methylidene]- 9H- carbazol- 3- amine
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/c1ccc2c(c1)c1ccccc1[nH]2

STK528432
Synonyms: 1- (4- fluorobenzyl)- 3- naphthalen- 1- yl- 1- [4- (9H- thioxanthen- 9- yl)phenyl]urea
Smiles: Fc1ccc(cc1)CN(C(=O)Nc1cccc2c1cccc2)c1ccc(cc1)C1c2ccccc2Sc2c1cccc2

STK528436
Synonyms: 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK528437
Synonyms: ethyl5- fluoro- 3- {[(3- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)F

STK528441
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [4- (diphenylmethyl)piperazin- 1- yl]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK528442
Synonyms: 2- [(2,2,4- trimethyl- 3,4- dihydroquinolin- 1(2H)- yl)methyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: CC1CC(C)(C)N(c2c1cccc2)CN1C(=O)c2c(C1=O)cccc2

STK528444
Synonyms: 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(c(c1)O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK528446
Synonyms: methyl5- bromo- 3- ({[3- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK528447
Synonyms: 2- (3,4- dichlorophenyl)- N- (4- methoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528448
Synonyms: methyl3- [(3,4- dihydroisoquinolin- 2(1H)- ylacetyl)amino]- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)C

STK528451
Synonyms: 2- (3,4- dichlorophenyl)- N- (2- methoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccccc1Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528452
Synonyms: methyl3- ({[4- (4- nitrophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])cccc2

STK528453
Synonyms: 3- ({(E)- [3- (hydroxymethyl)- 4- methoxyphenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: OCc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528454
Synonyms: N- (furan- 2- ylmethyl)- 6- (naphthalen- 1- yloxy)hexan- 1- amine
Smiles: C(CNCc1ccco1)CCCCOc1cccc2c1cccc2

STK528455
Synonyms: 4- [(E)- (hydroxyimino)methyl]- 2,2- dimethyl- 2,5- dihydro- 1H- imidazol- 1- ol
Smiles: O/N=C/C1=NC(N(C1)O)(C)C

STK528456
Synonyms: (3E)- 3- [(2- chlorophenyl)imino]- 2- (4- nitrophenyl)- 2,3- dihydro- 1H- inden- 1- one
Smiles: O=C1C(c2ccc(cc2)[N+](=O)[O-])/C(=N\c2ccccc2Cl)/c2c1cccc2

STK528457
Synonyms: N- benzyl- 2- oxo- 1- oxaspiro[4.5]decane- 4- carboxamide
Smiles: O=C(C1CC(=O)OC21CCCCC2)NCc1ccccc1

STK528458
Synonyms: 1- (4- tert- butylphenoxy)anthracene- 9,10- dione
Smiles: O=C1c2c(cccc2C(=O)c2c1cccc2)Oc1ccc(cc1)C(C)(C)C

STK528460
Synonyms: N- phenyl- N- propyl- 10H- phenothiazine- 10- carboxamide
Smiles: CCCN(C(=O)N1c2ccccc2Sc2c1cccc2)c1ccccc1

STK528462
Synonyms: methyl5- bromo- 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)Br

STK528463
Synonyms: 8- {4- [2- (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)c1c2ccccc2n(c1C)C

STK528464
Synonyms: 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK528465
Synonyms: 2,6- di- tert- butyl- 4- [2- (2- hydroxy- 5- nitrophenyl)- 1H- benzimidazol- 1- yl]phenol
Smiles: [O-][N+](=O)c1ccc(c(c1)c1nc2c(n1c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)cccc2)O

STK528466
Synonyms: methyl5- chloro- 3- {[(3- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)Cl

STK528467
Synonyms: 3,6- diamino- 2- [(3,4- dichlorophenyl)carbonyl]- 4- (4- hydroxyphenyl)thieno[2,3- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)O)c(N)c(s2)C(=O)c1ccc(c(c1)Cl)Cl

STK528470
Synonyms: dimethyl2- {2,2,8- trimethyl- 1- [(2E)- 3- (4- nitrophenyl)prop- 2- enoyl]- 3- thioxo- 2,3- dihydroquinolin- 4(1H)- ylidene}- 1,3- dithiole- 4,5- dicarboxylate
Smiles: COC(=O)C1=C(S/C(=C\2/c3cccc(c3N(C(C2=S)(C)C)C(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])C)/S1)C(=O)OC

STK528471
Synonyms: N- dodecyl- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CCCCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK528475
Synonyms: 5- [(1,3- benzothiazol- 2- ylsulfanyl)acetyl]- 5- methyl- 4- (2- methylpropyl)dihydrofuran- 2(3H)- one(non- preferredname)
Smiles: CC(CC1CC(=O)OC1(C)C(=O)CSc1nc2c(s1)cccc2)C

STK528476
Synonyms: 8- (heptylsulfanyl)- 3- methyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK528477
Synonyms: 4- {[(E)- (3- bromo- 2- hydroxyphenyl)methylidene]amino}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Oc1c(cccc1Br)/C=N/c1c(=O)n(n(c1C)C)c1ccccc1

STK528478
Synonyms: 4,4'- methanediylbis(1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazole- 3- thione)
Smiles: Cc1c(Cc2c(C)n(n(c2=S)c2ccccc2)C)c(=S)n(n1C)c1ccccc1

STK528479
Synonyms: 1- [6- (2- chloro- 5- methylphenoxy)hexyl]- 4- (2- methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCCCOc1cc(C)ccc1Cl

STK528481
Synonyms: 3- methyl- 8- (methylamino)- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(NC)nc2c1c(=O)[nH]c(=O)n2C

STK528483
Synonyms: 7- {4- [(3- chlorophenyl)carbonyl]piperazin- 1- yl}- 1- cyclopropyl- 6- fluoro- N- (5- methyl- 1,3- thiazol- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)Nc1ncc(s1)C

STK528484
Synonyms: 2- [(3- cyano- 4- ethyl- 7,7- dimethyl- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl)sulfanyl]- 2- phenylacetamide
Smiles: CCC1C(=C(SC(c2ccccc2)C(=O)N)NC2=C1C(=O)CC(C2)(C)C)C#N

STK528485
Synonyms: hexahydro- 1H- benzimidazole- 1,3(2H)- diol
Smiles: ON1CN(C2C1CCCC2)O

STK528488
Synonyms: (3E)- 3- [2- (7- chloroquinolin- 4- yl)hydrazinylidene]- 5- nitro- 1,3- dihydro- 2H- indol- 2- one
Smiles: Clc1ccc2c(c1)nccc2N/N=C\1/C(=O)Nc2c1cc(cc2)[N+](=O)[O-]

STK528489
Synonyms: 2- [(4- butoxy- 3- chlorobenzyl)sulfanyl]ethanamine
Smiles: CCCCOc1ccc(cc1Cl)CSCCN

STK528492
Synonyms: decyl(2E)- 3- [5- (4- chlorophenyl)furan- 2- yl]- 2- cyanoprop- 2- enoate
Smiles: CCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Cl)/C#N

STK528495
Synonyms: 1- {(1Z)- 1- [2- (6- bromo- 4- phenylquinazolin- 2- yl)hydrazinylidene]ethyl}naphthalen- 2- ol
Smiles: Brc1ccc2c(c1)c(nc(n2)N/N=C(\c1c(O)ccc2c1cccc2)/C)c1ccccc1

STK528497
Synonyms: 3,3,6,6- tetramethyl- 10- (3- nitrophenyl)- 3,4,6,7,9,10- hexahydroacridine- 1,8(2H,5H)- dione
Smiles: O=C1CC(C)(C)CC2=C1CC1=C(N2c2cccc(c2)[N+](=O)[O-])CC(CC1=O)(C)C

STK528498
Synonyms: 6- ({(2Z)- 3- (4- methoxyphenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}amino)hexanoicacid
Smiles: COc1ccc(cc1)/C=C(/C(=O)NCCCCCC(=O)O)\NC(=O)c1ccccc1

STK528499
Synonyms: ethyl3- {[N- (2,2- dimethoxyethyl)- N- methylglycyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN(CC(OC)OC)C)cc(cc2)F

STK528500
Synonyms: (E)- 1- (2,2- dimethyl- 1- oxido- 2H- imidazol- 4- yl)- N- hydroxymethanimine
Smiles: O/N=C/C1=NC([N+](=C1)[O-])(C)C

STK528501
Synonyms: 3- {[(E)- (4- hydroxy- 3,5- dimethoxyphenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cc(/C=N/n2c(=O)[nH]c3c(c2=O)[nH]c2c3cc(cc2)C)cc(c1O)OC

STK528502
Synonyms: 8- methyl- 3- {[(E)- (4- methylphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C

STK528504
Synonyms: dimethyl[(4- methoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1ccc(cc1)OC)Nc1ccccc1)OC

STK528506
Synonyms: methyl10- hydroxy- 11- (piperidin- 1- yl)undecanoate
Smiles: COC(=O)CCCCCCCCC(CN1CCCCC1)O

STK528507
Synonyms: 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK528509
Synonyms: 7- hexadecyl- 8- [(2- hydroxypropyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(O)C)nc2c1c(=O)[nH]c(=O)n2C

STK528510
Synonyms: 1- amino- 4- [(4- chlorophenyl)amino]- 2- (pyrrolidin- 1- yl)anthracene- 9,10- dione
Smiles: Clc1ccc(cc1)Nc1cc(N2CCCC2)c(c2c1C(=O)c1ccccc1C2=O)N

STK528513
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528515
Synonyms: 4- {3- (2,4- dichlorophenyl)- 5,6- dimethoxy- 1- [(4- methylphenyl)sulfonyl]- 1H- indol- 2- yl}butan- 2- one
Smiles: COc1cc2c(c3ccc(cc3Cl)Cl)c(n(c2cc1OC)S(=O)(=O)c1ccc(cc1)C)CCC(=O)C

STK528516
Synonyms: 3- {[(E)- (2- chlorophenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccccc1Cl

STK528517
Synonyms: 2- (2- methylphenyl)- 4- (4- nitrophenoxy)quinazoline
Smiles: Cc1ccccc1c1nc(Oc2ccc(cc2)[N+](=O)[O-])c2c(n1)cccc2

STK528518
Synonyms: 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)O

STK528519
Synonyms: (2Z)- 3- [(2,4- dichlorophenyl)amino]- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1ccc(c(c1)OC)OC

STK528521
Synonyms: (5E)- 1- methyl- 5- [1- (octadecylamino)ethylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCCCCCCCCCCCCCCCN/C(=C/1\C(=O)NC(=O)N(C1=O)C)/C

STK528522
Synonyms: 4- [(2E)- 2- (furan- 2- ylmethylidene)hydrazinyl]- 2- (4- methoxyphenyl)quinazoline
Smiles: COc1ccc(cc1)c1nc(N/N=C/c2ccco2)c2c(n1)cccc2

STK528523
Synonyms: dimethyl[(4- bromophenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1ccc(cc1)Br)Nc1ccccc1)OC

STK528526
Synonyms: 3- amino- N- (4- bromophenyl)- 4,6- bis(4- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1ccc(cc1)Br)c1ccc(cc1)OC

STK528527
Synonyms: N- {3- methyl- 1- oxo- 1- [(tributylstannanyl)oxy]butan- 2- yl}benzamide
Smiles: CCCC[Sn](OC(=O)C(C(C)C)NC(=O)c1ccccc1)(CCCC)CCCC

STK528528
Synonyms: N- (2- ethyl- 4- oxoquinazolin- 3(4H)- yl)- 4- hydroxy- 2- oxo- 1- propyl- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCn1c(=O)c(C(=O)Nn2c(CC)nc3c(c2=O)cccc3)c(c2c1cccc2)O

STK528532
Synonyms: N- {1- [1- (4- bromophenyl)- 2- (2- butyl- 2- hydroxyhexanoyl)hydrazinyl]- 1- oxopropan- 2- yl}- 4- methylbenzenesulfonamide(non- preferredname)
Smiles: CCCCC(C(=O)NN(C(=O)C(NS(=O)(=O)c1ccc(cc1)C)C)c1ccc(cc1)Br)(CCCC)O

STK528533
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- (octylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK528535
Synonyms: 2- {2- methyl- 1- oxo- 1- [(trimethylstannanyl)oxy]propan- 2- yl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)(C)C)O[Sn](C)(C)C

STK528536
Synonyms: 4- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 2- (2,4- dichlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528537
Synonyms: (1R,3Z,5R,7E)- 3,7- bis(3- nitrobenzylidene)bicyclo[3.3.1]nonane- 2,6- dione
Smiles: O=C1[C@@H]2C[C@H](C/C/1=C\c1cccc(c1)[N+](=O)[O-])C(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/C2

STK528538
Synonyms: 7- (3- bromobenzyl)- 8- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)n1nc(cc1C)C

STK528540
Synonyms: 3- amino- 1- (2- nitrophenyl)pyrrolidine- 2,5- dione
Smiles: NC1CC(=O)N(C1=O)c1ccccc1[N+](=O)[O-]

STK528541
Synonyms: 3- (4- fluorobenzyl)- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)F

STK528543
Synonyms: 1- prop- 2- en- 1- yl- 3- [(2Z)- 1- propylpyridin- 2(1H)- ylidene]thiourea
Smiles: CCCn1cccc/c/1=N/C(=S)NCC=C

STK528544
Synonyms: N- (2- hexyl- 4- oxoquinazolin- 3(4H)- yl)- 4- hydroxy- 1- methyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK528545
Synonyms: 5- (dimethylsulfonio)- 2,4,6- trioxo- 1- phenylhexahydropyrimidin- 5- ide
Smiles: O=C1NC(=O)[C-](C(=O)N1c1ccccc1)[S+](C)C

STK528546
Synonyms: 3- (4- fluorophenoxy)- 2- methyl- N- (tetrahydrofuran- 2- ylmethyl)propan- 1- amine
Smiles: CC(COc1ccc(cc1)F)CNCC1CCCO1

STK528547
Synonyms: (2E)- 2- [4- (4- fluorophenyl)- 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(cc1)F

STK528549
Synonyms: (7E)- 3,4- diphenyl- 7- (3,4,5- trimethoxybenzylidene)- 4H- [1,3]thiazolo[2,3- c][1,2,4]triazin- 6(7H)- one
Smiles: COc1cc(cc(c1OC)OC)/C=c\1/sc2=NN=C(C(n2c1=O)c1ccccc1)c1ccccc1

STK528551
Synonyms: N- (butan- 2- yl)- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCC(NC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)C

STK528553
Synonyms: (2E)- 3- [(4- bromophenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Br)/c1scc(n1)c1cc2ccccc2oc1=O

STK528554
Synonyms: methyl3- {[(4- benzylpiperazin- 1- yl)acetyl]amino}- 5- chloro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)Cl

STK528555
Synonyms: 2- (4- chlorophenyl)- N- (3,5- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2cc(Cl)cc(c2)Cl)c2c(n1)cccc2

STK528556
Synonyms: 3- [2- (morpholin- 4- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(CCN2CCOCC2)cnc2c1[nH]c1c2cccc1

STK528557
Synonyms: hexyl2- ({[3- (trifluoromethyl)phenyl]carbamoyl}amino)benzoate
Smiles: CCCCCCOC(=O)c1ccccc1NC(=O)Nc1cccc(c1)C(F)(F)F

STK528558
Synonyms: (2E,2'E)- N,N'- (1,3- dimethyl- 2- oxoimidazolidine- 4,5- diyl)bis(2- benzylidenehydrazinecarboxamide)
Smiles: CN1C(NC(=O)N/N=C/c2ccccc2)C(N(C1=O)C)NC(=O)N/N=C/c1ccccc1

STK528559
Synonyms: 2,4- dichloro- 6- {(E)- [2- (pentafluorophenyl)hydrazinylidene]methyl}phenol
Smiles: Clc1cc(/C=N/Nc2c(F)c(F)c(c(c2F)F)F)c(c(c1)Cl)O

STK528560
Synonyms: 6- [(E)- (2- {[(2,3- dihydro- 1,4- benzodioxin- 6- ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]- 2,3- dimethoxybenzoicacid(non- preferredname)
Smiles: COc1ccc(c(c1OC)C(=O)O)/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCCO2

STK528562
Synonyms: 3- [2- (4- bromophenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]- N- (propan- 2- yl)propan- 1- amine
Smiles: CC(NCCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br)C

STK528563
Synonyms: 4- (thiomorpholin- 4- yl)- 5H- pyrimido[5,4- b]indole
Smiles: S1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1

STK528565
Synonyms: 3- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C

STK528567
Synonyms: 2- amino- 4- ethyl- 6- (propylsulfanyl)pyridine- 3,5- dicarbonitrile
Smiles: CCCSc1nc(N)c(c(c1C#N)CC)C#N

STK528568
Synonyms: 8- methoxy- 3- {[(E)- (4- methylphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C

STK528569
Synonyms: 2- (4- chlorophenyl)- 4- {(2E)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl)/C

STK528570
Synonyms: ethyl4- [(5E)- 5- (2,4- dimethoxybenzylidene)- 2,4,6- trioxotetrahydropyrimidin- 1(2H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(cc2OC)OC)/C1=O

STK528572
Synonyms: N'- [hydroxy(diphenyl)acetyl]- 5- methyl- N- phenylthiophene- 3- carbohydrazide
Smiles: Cc1scc(c1)C(=O)N(c1ccccc1)NC(=O)C(c1ccccc1)(c1ccccc1)O

STK528573
Synonyms: 6- methyl- 3- (trimethylstannanyl)pyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1cc(=O)n(c(=O)[nH]1)[Sn](C)(C)C

STK528575
Synonyms: benzylN- {(2E)- 3- (4- bromophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}leucinate
Smiles: Brc1ccc(cc1)/C=C(\C(=O)NC(C(=O)OCc1ccccc1)CC(C)C)/NC(=O)c1ccccc1

STK528576
Synonyms: ethyl4- (3- bromo- 2- hydroxyphenyl)- 1,6- dimethyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CC1=C(C(NC(=O)N1C)c1cccc(c1O)Br)C(=O)OCC

STK528577
Synonyms: 2- (2,4- dichlorophenyl)- 4- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(OC)ccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528580
Synonyms: ethyl2- ({4- [(2,6- dimethoxypyrimidin- 4- yl)sulfamoyl]phenyl}amino)- 3,3,3- trifluoro- N- (furan- 2- ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)Nc1ccc(cc1)S(=O)(=O)Nc1cc(OC)nc(n1)OC

STK528582
Synonyms: (2E)- 2- cyano- 2- (6,7,8,9,9a,10,11,12,13,14- decahydro- 2H- benzimidazo[2,1- e]acridin- 2- ylidene)ethanamide
Smiles: N#C/C(=c\1/ccc2=NC34N(c2c1)C1=C(CCCC1)CC4CCCC3)/C(=O)N

STK528583
Synonyms: 2- (2,4- dichlorophenyl)- N- (4- methylphenyl)quinazolin- 4- amine
Smiles: Cc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528584
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 1- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c(C)n(c2c1cc(OC)cc2)C

STK528585
Synonyms: (2Z)- 2- (4,5- dimethoxy- 2- nitrophenyl)- 3- (naphthalen- 1- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1cccc2c1cccc2)/c1cc(OC)c(cc1[N+](=O)[O-])OC

STK528587
Synonyms: 3- chloro- 7- (piperidin- 1- yl)- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Clc1ccc2c(c1)oc1c([nH]2)c2c(=O)c3ccccc3c(=O)c2c(c1)N1CCCCC1

STK528589
Synonyms: 3- [4- (9H- fluoren- 2- yl)- 1,3- thiazol- 2- yl]- 2- oxo- 2H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1scc(n1)c1ccc2c(c1)Cc1c2cccc1

STK528590
Synonyms: 1- ethyl- 6- fluoro- N- heptyl- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK528591
Synonyms: N- {4- [3- (4- methoxyphenyl)- 4- oxo- 1,2,3,4- tetrahydroquinazolin- 2- yl]phenyl}acetamide
Smiles: COc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(cc1)NC(=O)C

STK528593
Synonyms: 3- {[(E)- (3- bromo- 2- hydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528595
Synonyms: methyl3- {[(4- benzylpiperazin- 1- yl)acetyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)C

STK528596
Synonyms: 5- {2- ethoxy- 5- [(1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)sulfonyl]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)N1CC2(CC1CC(C2)(C)C)C)C

STK528598
Synonyms: 8- [(2- hydroxyethyl)sulfanyl]- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCSc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C

STK528599
Synonyms: 2,2'- {[4- (2- chloroethyl)phenyl]methanediyl}bis(5,5- dimethylcyclohexane- 1,3- dione)
Smiles: ClCCc1ccc(cc1)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK528601
Synonyms: N- (4- phenyl- 1,3- thiazol- 2- yl)- N'- undecylethanediamide
Smiles: CCCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)c1ccccc1

STK528603
Synonyms: (2Z)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1cccc(c1)Br

STK528606
Synonyms: (2Z)- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc(cc1)C

STK528608
Synonyms: N- [3- (diethylamino)propyl]- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCN(CCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)CC

STK528609
Synonyms: 2- (1- methyl- 5- oxo- 2- thioxoimidazolidin- 4- yl)acetamide
Smiles: CN1C(=O)C(NC1=S)CC(=O)N

STK528610
Synonyms: 4- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc2ccccc2n2c1nnc2

STK528613
Synonyms: 3,4- dichloro- N- [(1Z)- 8- ethoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: CCOc1ccc2c(c1)c1/c(=N/c3ccc(c(c3)Cl)Cl)/ssc1C(N2)(C)C

STK528614
Synonyms: 1,2,3,4,9,9- hexachloro- 7- (dibutylcarbamoyl)- 5- methyl- 1,4,4a,5,6,7,8,8a- octahydro- 1,4- methanonaphthalene- 6- carboxylicacid
Smiles: CCCCN(C(=O)C1CC2C(C(C1C(=O)O)C)C1(C(C2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl)CCCC

STK528615
Synonyms: 8- methyl- 4- (4- methylpiperazin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CN1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)C

STK528617
Synonyms: N- [4- (1,3- dioxo- 2,3- dihydro- 1H- inden- 2- yl)phenyl]butanamide
Smiles: CCCC(=O)Nc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2

STK528619
Synonyms: 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)OC

STK528620
Synonyms: 3,7- bis(benzylsulfanyl)- 1,5- diphenyl- 1H,5H- [1,2,4]triazolo[1,2- a][1,2,4]triazole
Smiles: c1ccc(cc1)C1N=C(N2N1C(=NC2c1ccccc1)SCc1ccccc1)SCc1ccccc1

STK528622
Synonyms: 4- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 2- (2- chlorophenyl)quinazoline
Smiles: Clc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK528623
Synonyms: (2E)- 5,6- diphenyl- 2- (3,4,5- trimethoxybenzylidene)imidazo[2,1- b][1,3]thiazol- 3(2H)- one
Smiles: COc1cc(cc(c1OC)OC)/C=c\1/sc2n(c1=O)c(c(n2)c1ccccc1)c1ccccc1

STK528625
Synonyms: 3- {[(E)- (2- hydroxy- 5- methoxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(c(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C)O

STK528627
Synonyms: N'- (7- butyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)formichydrazide
Smiles: CCCCn1c(NNC=O)nc2c1c(=O)[nH]c(=O)n2C

STK528629
Synonyms: 4- methyl- N- [(1E)- 1- [4- (methylsulfanyl)phenyl]- 3- oxo- 3- {[3- (trifluoromethyl)phenyl]amino}prop- 1- en- 2- yl]benzamide
Smiles: CSc1ccc(cc1)/C=C(\C(=O)Nc1cccc(c1)C(F)(F)F)/NC(=O)c1ccc(cc1)C

STK528630
Synonyms: (4E)- 4- {[5- (2- nitrophenyl)furan- 2- yl]methylidene}- 2- phenyl- 5- [(phenylsulfanyl)methyl]- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: O=C1N(N=C(/C/1=C\c1ccc(o1)c1ccccc1[N+](=O)[O-])CSc1ccccc1)c1ccccc1

STK528631
Synonyms: diphenyl[(4- methoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccccc1

STK528632
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- N- [2- (morpholin- 4- yl)ethyl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCCN2CCOCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK528633
Synonyms: 2- methyl- 3- ({(E)- [4- (prop- 2- en- 1- yloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCOc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK528635
Synonyms: 8- methoxy- 2- methyl- 3- {[(E)- (4- methylphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C

STK528636
Synonyms: (7- amino- 2,2,4- trimethyl- 4- phenyl- 3,4- dihydroquinolin- 1(2H)- yl)[4- (propan- 2- yl)phenyl]methanone
Smiles: Nc1ccc2c(c1)N(C(=O)c1ccc(cc1)C(C)C)C(CC2(C)c1ccccc1)(C)C

STK528637
Synonyms: 2- [(6- chloro- 1,3- benzoxazol- 2- yl)sulfanyl]- N,N- dimethylacetamide
Smiles: Clc1ccc2c(c1)oc(n2)SCC(=O)N(C)C

STK528638
Synonyms: 1- (azepan- 1- yl)- 3- (diphenylamino)propan- 2- ol
Smiles: OC(CN1CCCCCC1)CN(c1ccccc1)c1ccccc1

STK528639
Synonyms: 1- (4'- nitrobiphenyl- 4- yl)- 3- [3- (trifluoromethyl)phenyl]urea
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]

STK528641
Synonyms: methyl5- chloro- 3- {[(2- ethylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCC1CCCCN1CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK528643
Synonyms: 2- (3- {[(4Z)- 4- (4- hydroxy- 3- methoxybenzylidene)- 5- oxo- 1- (2,4,6- trichlorophenyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]carbamoyl}phenyl)- 1,3- dioxo- 2,3- dihydro- 1H- isoindole- 5- carboxylicacid
Smiles: COc1cc(ccc1O)/C=C\1/C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)NC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O

STK528644
Synonyms: N,2- bis[2- (3,4- dimethoxyphenyl)ethyl]- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinoline- 6- carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)CCc1ccc(c(c1)OC)OC

STK528645
Synonyms: 7- methyl- 6H- [1,2,5]oxadiazolo[3,4- e]indole
Smiles: Cc1[nH]c2c(c1)c1nonc1cc2

STK528646
Synonyms: 2- (4- methylphenyl)- 1- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: Cc1ccc(cc1)c1cn2c(n1CCN1CCCCC1)nc1c2cccc1

STK528648
Synonyms: ethyl3- {(E)- [4- (4- fluorophenyl)piperazin- 1- yl]diazenyl}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccc(cc1)F)cc(cc2)OC

STK528650
Synonyms: 3- [2- (piperazin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(CCN2CCNCC2)cnc2c1[nH]c1c2cccc1

STK528651
Synonyms: N- (4- bromophenyl)- 2- (4- chlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2ccc(cc2)Br)c2c(n1)cccc2

STK528653
Synonyms: 3- {[(E)- (3- hydroxy- 4- methoxyphenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK528654
Synonyms: 3- (hydroxymethyl)- 1,3- benzoxazole- 2(3H)- thione
Smiles: OCn1c(=S)oc2c1cccc2

STK528655
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- [4- (9H- fluoren- 9- yl)piperazin- 1- yl]ethanone
Smiles: O=C(c1c2ccccc2n(c1C)C)CN1CCN(CC1)C1c2ccccc2c2c1cccc2

STK528656
Synonyms: (3E)- 2- (diphenylacetyl)- 3- {(2E)- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]hydrazinylidene}- 2,3- dihydro- 1H- inden- 1- one
Smiles: O=C(C1C(=O)c2c(/C/1=N/N=C/C=C/c1ccco1)cccc2)C(c1ccccc1)c1ccccc1

STK528657
Synonyms: 5- bromo- 2- iodo- N- [2- (pyridin- 4- yl)- 1,3- benzoxazol- 5- yl]benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1ccc2c(c1)nc(o2)c1ccncc1)I

STK528658
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(2- iodophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccc2c(c1)OCO2

STK528659
Synonyms: 2- (butylsulfanyl)- 5- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 6- hydroxy- 3- methylpyrimidin- 4(3H)- one
Smiles: CCCCSc1nc(O)c(c(=O)n1C)C1OC(=O)c2c1ccc(c2OC)OC

STK528660
Synonyms: (2E)- 2- [4- (heptyloxy)benzylidene]- N- (4- propoxybenzyl)hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OCCC

STK528661
Synonyms: 10- [3- (dibutylamino)- 2- hydroxypropyl]acridin- 9(10H)- one
Smiles: CCCCN(CC(Cn1c2ccccc2c(=O)c2c1cccc2)O)CCCC

STK528662
Synonyms: 1- [4- (4- fluorophenoxy)butyl]- 3,5- dimethylpiperidine
Smiles: CC1CN(CCCCOc2ccc(cc2)F)CC(C1)C

STK528664
Synonyms: 8- methyl- 3- (pyridin- 2- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccccn1

STK528666
Synonyms: 2- phenyl- 1- [2- (pyrrolidin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: c1ccc(cc1)c1cn2c(n1CCN1CCCC1)nc1c2cccc1

STK528667
Synonyms: 8- [(3- chloro- 2- hydroxypropyl)sulfanyl]- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(CCl)O)nc2c1c(=O)[nH]c(=O)n2C

STK528669
Synonyms: ethyl(2- {[(1- ethyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)carbonyl]amino}- 1,3- thiazol- 4- yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)c1c(O)c2ccccc2n(c1=O)CC

STK528670
Synonyms: 8- [(2E)- 2- (2- hydroxybenzylidene)hydrazinyl]- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(N/N=C/c2ccccc2O)nc2c1c(=O)[nH]c(=O)n2C)C

STK528671
Synonyms: 2- (2,4- dichlorophenyl)- N,N- diethylquinazolin- 4- amine
Smiles: CCN(c1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)CC

STK528672
Synonyms: dipropan- 2- yl{(E)- amino[2- (4- nitrophenyl)hydrazinylidene]methyl}phosphonate
Smiles: CC(OP(=O)(/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/N)OC(C)C)C

STK528673
Synonyms: N- tert- butyl- 2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinecarbothioamide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)NNC(=S)NC(C)(C)C

STK528676
Synonyms: 7- hexadecyl- 3- methyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1

STK528677
Synonyms: 7- heptyl- 3- methyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1

STK528678
Synonyms: 2- (3,4- dichlorophenyl)- N,N- diethylquinazolin- 4- amine
Smiles: CCN(c1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)CC

STK528680
Synonyms: 4- (3,4- dimethylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (pyridin- 4- ylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(c(c1)C)C)/C=N/NC(=O)c1ccncc1

STK528682
Synonyms: 3- {[(tributylstannanyl)oxy]carbonyl}pyridine
Smiles: CCCC[Sn](OC(=O)c1cccnc1)(CCCC)CCCC

STK528683
Synonyms: 1- (2- methylprop- 2- en- 1- yl)pyrrolidine- 2,5- dione
Smiles: CC(=C)CN1C(=O)CCC1=O

STK528684
Synonyms: 3- imino- 1- methyl- 5- phenyl- 7- propyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: CCCC1C2(C)OC(=N)C(C1(C#N)C#N)(C(O2)c1ccccc1)C#N

STK528685
Synonyms: 8- methoxy- 3- {[(E)- (2,3,4- trimethoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1OC)OC)OC

STK528686
Synonyms: 8- (benzylamino)- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK528687
Synonyms: 1- [4,6- bis(dimethylamino)- 1,3,5- triazin- 2- yl]- 3- (4- chlorophenyl)- 2- imino- 5- methylimidazolidin- 4- one
Smiles: Clc1ccc(cc1)N1C(=O)C(N(C1=N)c1nc(nc(n1)N(C)C)N(C)C)C

STK528688
Synonyms: ethyl5- methoxy- 3- {[(3- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)OC

STK528689
Synonyms: N- {4- tert- butyl- 1- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- N- nitroso- 3- (trifluoromethyl)aniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1c(C)cccc1C)c1cccc(c1)C(F)(F)F

STK528690
Synonyms: 8- [(4- chlorobenzyl)sulfanyl]- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C

STK528691
Synonyms: 8- bromo- 3- ({(E)- [4- (prop- 2- en- 1- yloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK528692
Synonyms: ethyl2- (1,3- benzothiazol- 2- ylamino)- 3,3,3- trifluoro- N- (pyridin- 3- ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)Nc1nc2c(s1)cccc2

STK528693
Synonyms: 8- chloro- 3- [2- (2- methoxyphenyl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccccc1CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK528694
Synonyms: N- (4- nitrophenyl)- N'- [(4Z)- 2- oxo- 1,2- dihydro- 4H- 3,1- benzoxazin- 4- ylidene]acetohydrazide
Smiles: CC(=O)N(c1ccc(cc1)[N+](=O)[O-])/N=c/1\oc(=O)[nH]c2c1cccc2

STK528698
Synonyms: 2- (2,4- dichlorophenyl)- 4- [(2E)- 2- (3- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528699
Synonyms: 4- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 2- (4- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2Cl)c2c(n1)cccc2

STK528700
Synonyms: 2- hydroxy- 2,2- bis(4- methoxyphenyl)- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: COc1ccc(cc1)C(c1ccc(cc1)OC)(C(=O)N/N=C/C=C/c1ccccc1)O

STK528701
Synonyms: 2,2'- {[3- (hydroxymethyl)- 4- methoxyphenyl]methanediyl}bis(5,5- dimethylcyclohexane- 1,3- dione)
Smiles: OCc1cc(ccc1OC)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

STK528702
Synonyms: 4- (acryloylamino)- 4- methyltetrahydrothiophene- 3- sulfonicacid1,1- dioxide
Smiles: C=CC(=O)NC1(C)CS(=O)(=O)CC1S(=O)(=O)O

STK528703
Synonyms: 4- {[3- (methylamino)- 3- oxopropanoyl]amino}benzoicacid
Smiles: CNC(=O)CC(=O)Nc1ccc(cc1)C(=O)O

STK528704
Synonyms: 3- methyl- 8- [(2E)- 2- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C

STK528705
Synonyms: (2E)- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1C)[N+](=O)[O-])/C#N

STK528706
Synonyms: 1,7- dibenzyl- 3- methyl- 8- [(4- methylbenzyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)CNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK528707
Synonyms: 8- (diethylamino)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(CC)CC

STK528708
Synonyms: 3,3'- ({3- [(3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)methyl]- 4- methoxyphenyl}methanediyl)bis(4- hydroxy- 2H- chromen- 2- one)
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2

STK528710
Synonyms: 4- (4- methylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: Cc1cc[n+](cc1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1

STK528712
Synonyms: methyl3- ({[4- (4- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cccc2

STK528713
Synonyms: ethyl4- (4- hydroxy- 3- methoxyphenyl)- 6- {[4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]methyl}- 1- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(CN2CCN(C(C2)C)c2cccc(c2)OC)N(C(=O)NC1c1ccc(c(c1)OC)O)C

STK528714
Synonyms: 1- [2- (2,6- dimethoxyphenoxy)ethyl]- 4- [3- (trifluoromethyl)phenyl]piperazine
Smiles: COc1cccc(c1OCCN1CCN(CC1)c1cccc(c1)C(F)(F)F)OC

STK528715
Synonyms: 3,4- dichloro- 1- {6- oxo- 6- [(trimethylstannanyl)oxy]hexyl}- 1H- pyrrole- 2,5- dione
Smiles: O=C(O[Sn](C)(C)C)CCCCCN1C(=O)C(=C(C1=O)Cl)Cl

STK528717
Synonyms: 2- (3,4- dichlorophenyl)- 4- (piperidin- 1- yl)quinazoline
Smiles: Clc1ccc(cc1Cl)c1nc(N2CCCCC2)c2c(n1)cccc2

STK528718
Synonyms: ethyl5- methoxy- 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)OC

STK528719
Synonyms: ethyl3,3,3- trifluoro- 2- [(2- fluorophenyl)amino]- N- (pyridin- 3- ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1ccccc1F)NC(=O)c1cccnc1

STK528720
Synonyms: N- decyl- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK528722
Synonyms: 8,8,10,10- tetramethyl- 2- {2- [2- (pyridin- 3- yl)piperidin- 1- yl]ethyl}- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1(C)Cc2c3c(sc2C(N1)(C)C)ncn1c3nc(n1)CCN1CCCCC1c1cccnc1

STK528724
Synonyms: 8- (dimethylamino)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)C

STK528729
Synonyms: (3Z)- 3- [(2E)- (5,5- dimethyl- 4- oxo- 1,3- thiazolidin- 2- ylidene)hydrazinylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=N/N=C/1\NC(=O)C(S1)(C)C)cccc2

STK528731
Synonyms: N- (2- {1- (4- bromophenyl)- 2- [hydroxy(diphenyl)acetyl]hydrazinyl}- 2- oxoethyl)- 4- methylbenzenesulfonamide(non- preferredname)
Smiles: Brc1ccc(cc1)N(C(=O)CNS(=O)(=O)c1ccc(cc1)C)NC(=O)C(c1ccccc1)(c1ccccc1)O

STK528732
Synonyms: methylN- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 2- {[(2,4- dichlorophenyl)carbonyl]amino}- 3,3,3- trifluoroalaninate
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1Cl)Cl

STK528735
Synonyms: N- {4- [(1E)- 3- oxo- 2- (phenylcarbonyl)but- 1- en- 1- yl]phenyl}propanamide
Smiles: CCC(=O)Nc1ccc(cc1)/C=C(/C(=O)c1ccccc1)\C(=O)C

STK528737
Synonyms: 7- [4- (dimethylamino)phenyl]- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: O=c1oc2ccccc2c2c1C(c1ccc(cc1)N(C)C)c1c(=O)oc3c(c1O2)cccc3

STK528740
Synonyms: methyl3- ({3- [4- (2- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)C

STK528741
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4- dichlorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1ccc(cc1)Cl

STK528742
Synonyms: methyl{[6- amino- 4- (4- bromophenyl)- 3,5- dicyanopyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(N)c(c(c1C#N)c1ccc(cc1)Br)C#N

STK528743
Synonyms: 3- (biphenyl- 4- yl)- 5- (5- methylfuran- 2- yl)- 1- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: Cc1ccc(o1)C1CC(=NN1c1ccccc1)c1ccc(cc1)c1ccccc1

STK528744
Synonyms: 8- {(2E)- 2- [1- (2- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(=O)[nH]c(=O)n2C

STK528745
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1F

STK528746
Synonyms: 3- [2- (dipropan- 2- ylamino)ethyl]- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN(C(C)C)C(C)C

STK528748
Synonyms: 2- (2,4- dichlorophenyl)- 4- (4- methylpiperazin- 1- yl)quinazoline
Smiles: CN1CCN(CC1)c1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528749
Synonyms: N- (2- chlorophenyl)- 2- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1cc(ccc1Cl)c1nc(Nc2ccccc2Cl)c2c(n1)cccc2

STK528750
Synonyms: 4- oxo- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 3- azaspiro[5.5]undec- 1- ene- 1,5- dicarbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=O)C(C21CCCCC2)C#N

STK528751
Synonyms: 7- hexyl- 3- methyl- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STK528752
Synonyms: diethyl1- (3- chlorophenyl)- 2,6- dimethyl- 4- (4- nitrophenyl)- 1,4- dihydropyridine- 3,5- dicarboxylate
Smiles: CCOC(=O)C1=C(C)N(C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)OCC)C)c1cccc(c1)Cl

STK528754
Synonyms: 3- methyl- 8- (morpholin- 4- yl)- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(C(C)C)c(n2)N1CCOCC1)C

STK528755
Synonyms: 2- bromo- 6- {(E)- [2- (pentafluorophenyl)hydrazinylidene]methyl}phenol
Smiles: Brc1cccc(c1O)/C=N/Nc1c(F)c(F)c(c(c1F)F)F

STK528756
Synonyms: N- {4- tert- butyl- 1- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]cyclohexyl}- 4- chloro- N- nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1c(C)cccc1C)c1ccc(cc1)Cl

STK528757
Synonyms: dibutyl2,2'- (2- oxo- 1H- benzimidazole- 1,3(2H)- diyl)diacetate
Smiles: CCCCOC(=O)Cn1c2ccccc2n(c1=O)CC(=O)OCCCC

STK528758
Synonyms: 5- [(E)- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}methyl]- 4- (isoquinolinium- 2- yl)- 2- oxo- 1,3- thiazol- 3- ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1O)[n+]1ccc2c(c1)cccc2

STK528759
Synonyms: 3,3'- [(4- methoxyphenyl)methanediyl]bis(2- phenyl- 1H- indole)
Smiles: COc1ccc(cc1)C(c1c([nH]c2c1cccc2)c1ccccc1)c1c([nH]c2c1cccc2)c1ccccc1

STK528760
Synonyms: 2- [bis(5- methylfuran- 2- yl)methyl]- 4- methoxy- 6- nitrophenol
Smiles: COc1cc(C(c2ccc(o2)C)c2ccc(o2)C)c(c(c1)[N+](=O)[O-])O

STK528762
Synonyms: 1- {(E)- [(2- hydroxyphenyl)imino]methyl}- 3- nitro- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 2- ol
Smiles: [O-][N+](=O)c1cc2oc3c(c2c(c1O)/C=N/c1ccccc1O)CCCC3

STK528763
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- [5- (2- methylpropyl)- 1,3,4- thiadiazol- 2- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2nnc(s2)CC(C)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK528765
Synonyms: 8- bromo- 3- ({(E)- [4- (dimethylamino)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)N(C)C

STK528766
Synonyms: 4- [2- amino- 3- cyano- 4,4- bis(trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- cyclopenta[b]pyridin- 1- yl]- N- (4,6- dimethylpyrimidin- 2- yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2nc(C)cc(n2)C)C2=C(C1(C(F)(F)F)C(F)(F)F)CCC2

STK528768
Synonyms: 8- (benzylsulfanyl)- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK528769
Synonyms: 2- [4- (4- chlorophenyl)piperazin- 1- yl]- 1- (1H- indol- 3- yl)ethanone
Smiles: Clc1ccc(cc1)N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK528770
Synonyms: N- {(1E)- 1- [4- (diethylamino)phenyl]- 3- [(2E)- 2- (4- hydroxy- 3,5- dimethoxybenzylidene)hydrazinyl]- 3- oxoprop- 1- en- 2- yl}benzamide
Smiles: CCN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1cc(OC)c(c(c1)OC)O)/NC(=O)c1ccccc1)CC

STK528771
Synonyms: ethyl3- {[(4- benzylpiperazin- 1- yl)acetyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)F

STK528772
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1O)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK528773
Synonyms: 4- (2- amino- 3,5- dicyano- 6- {[2- (4- methylphenyl)- 2- oxoethyl]sulfanyl}pyridin- 4- yl)phenylacetate
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)C)nc(c(c1c1ccc(cc1)OC(=O)C)C#N)N

STK528776
Synonyms: 8- bromo- 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)Br

STK528778
Synonyms: ethyl2- oxo- 4- (undecylamino)- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC

STK528782
Synonyms: 7- [3- (4- bromophenoxy)- 2- hydroxypropyl]- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C)COc1ccc(cc1)Br

STK528784
Synonyms: ethyl(2S)- 2- propyl- 1- oxaspiro[2.5]octane- 2- carboxylate
Smiles: CCC[C@@]1(OC21CCCCC2)C(=O)OCC

STK528786
Synonyms: N- (2- chlorophenyl)- 2- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2ccccc2Cl)c2c(n1)cccc2

STK528787
Synonyms: (6E)- 6- (3- hydroxy- 4- methoxybenzylidene)- 1,3- dimethyl- 3a,9a- diphenyl- 3,3a,9,9a- tetrahydroimidazo[4,5- e][1,3]thiazolo[3,2- b][1,2,4]triazine- 2,7(1H,6H)- dione
Smiles: COc1ccc(cc1O)/C=c\1/sc2=NC3(C(Nn2c1=O)(c1ccccc1)N(C(=O)N3C)C)c1ccccc1

STK528789
Synonyms: 4- (butylamino)- 6- chloro- 2- (methylsulfanyl)pyrimidine- 5- carbonitrile
Smiles: CCCCNc1nc(SC)nc(c1C#N)Cl

STK528791
Synonyms: 1,3- dimethyl- 2- [(1E)- prop- 1- en- 1- yl]- 2,3- dihydro- 1H- benzimidazole
Smiles: C/C=C/C1N(C)c2c(N1C)cccc2

STK528792
Synonyms: methyl{[6- amino- 3,5- dicyano- 4- (2- methylpropyl)pyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(N)c(c(c1C#N)CC(C)C)C#N

STK528793
Synonyms: dimethyl{[(2,4- dimethylphenyl)amino](phenyl)methyl}phosphonate
Smiles: COP(=O)(C(c1ccccc1)Nc1ccc(cc1C)C)OC

STK528796
Synonyms: 1,7- dibenzyl- 8- {(2E)- 2- [1- (4- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Oc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)/C

STK528797
Synonyms: [1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (chloromethyl)- 1H- 1,2,3- triazol- 4- yl]methanol
Smiles: ClCc1c(CO)nnn1c1nonc1N

STK528799
Synonyms: 1,1'- benzene- 1,3- diylbis[3- (4- fluorophenyl)(thiourea)]
Smiles: S=C(Nc1ccc(cc1)F)Nc1cccc(c1)NC(=S)Nc1ccc(cc1)F

STK528800
Synonyms: 2- (4- chlorophenyl)- 4- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2)Cl)ccc1OC

STK528801
Synonyms: N- [(4Z)- 4- (4- hydroxy- 3- methoxybenzylidene)- 5- oxo- 1- (2,4,6- trichlorophenyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 3- nitrobenzamide
Smiles: COc1cc(ccc1O)/C=C\1/C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)NC(=O)c1cccc(c1)[N+](=O)[O-]

STK528802
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)- 2- [4- (diphenylmethyl)piperazin- 1- yl]ethanone
Smiles: O=C(c1c2ccccc2n(c1C)C)CN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK528807
Synonyms: 3- {[(E)- (2- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528809
Synonyms: 7- (3- {[4- chloro- 5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 4- methoxyphenyl)- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK528810
Synonyms: 4- [(1E)- 1- {2- [2- (4- methoxyphenyl)quinazolin- 4- yl]hydrazinylidene}ethyl]phenol
Smiles: COc1ccc(cc1)c1nc(N/N=C(/c2ccc(cc2)O)\C)c2c(n1)cccc2

STK528812
Synonyms: methyl5- methyl- 3- {[3- (pyrrolidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCCC1)cc(cc2)C

STK528814
Synonyms: 3- bromo- 1- {(E)- [(6- methylpyridin- 2- yl)imino]methyl}- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 2- ol
Smiles: Cc1cccc(n1)/N=C/c1c(O)c(Br)cc2c1c1CCCCc1o2

STK528815
Synonyms: [4- chloro- 6- (dimethylamino)- 1,3,5- triazin- 2- yl](2- chloroethyl)cyanamide
Smiles: ClCCN(c1nc(Cl)nc(n1)N(C)C)C#N

STK528816
Synonyms: (5E)- 1- (4- ethoxyphenyl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)/C(=C\NN2CCCCC2c2cccnc2)/C1=O

STK528820
Synonyms: 5- phenyl- 2,4- bis(2,4,6- trimethylphenyl)- 1H- imidazole
Smiles: Cc1cc(C)c(c(c1)C)c1[nH]c(c(n1)c1c(C)cc(cc1C)C)c1ccccc1

STK528821
Synonyms: 2- [4- (4- fluorophenyl)piperazin- 1- yl]- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1ccc(cc1)F

STK528822
Synonyms: 4- (3- ethylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: CCc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1

STK528824
Synonyms: N- {2- [(6- ethoxy- 1,3- benzothiazol- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}pyridine- 3- carboxamide
Smiles: CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1

STK528827
Synonyms: N~6~- benzyl- N~4~- cyclohexyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)cc(c2c1non2)NC1CCCCC1

STK528828
Synonyms: 3- methyl- 7- (3- phenylpropyl)- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCCc1ccccc1)c(n2)N1CCNCC1)C

STK528831
Synonyms: 3- methyl- 7- nonyl- 8- (nonylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCSc1nc2c(n1CCCCCCCCC)c(=O)[nH]c(=O)n2C

STK528832
Synonyms: 4- methyl- 1,2,3- thiadiazole- 5- carbohydrazide
Smiles: NNC(=O)c1snnc1C

STK528833
Synonyms: 2- chloro- N- [2- (3- fluorophenyl)- 1,3- benzoxazol- 5- yl]- 5- iodobenzamide
Smiles: Fc1cccc(c1)c1nc2c(o1)ccc(c2)NC(=O)c1cc(I)ccc1Cl

STK528834
Synonyms: 8- bromo- 3- {[(E)- (3- bromo- 2- hydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)Br

STK528835
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- (4- methylpyridin- 2- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2nccc(c2)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK528837
Synonyms: furan- 2- yl(4- {2- [2- (naphthalen- 1- yloxy)ethoxy]ethyl}piperazin- 1- yl)methanone
Smiles: O=C(c1ccco1)N1CCN(CC1)CCOCCOc1cccc2c1cccc2

STK528839
Synonyms: (2E)- 2- [4- (heptyloxy)benzylidene]- N- (4- methoxybenzyl)hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OC

STK528840
Synonyms: N- (2- chlorobenzyl)- 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccc2Cl)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK528841
Synonyms: 8- {(2E)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(N/N=C(/c2ccc(cc2)OC)\C)nc2c1c(=O)[nH]c(=O)n2C

STK528842
Synonyms: 5,5'- diphenyl- 3,3'- bi- 1,2,4- oxadiazole
Smiles: c1ccc(cc1)c1onc(n1)c1noc(n1)c1ccccc1

STK528843
Synonyms: (2E)- 1- (2,4- dinitrophenyl)- 2- [2- methyl- 5- (propan- 2- ylidene)cyclopentylidene]hydrazine
Smiles: CC1CCC(=C(C)C)/C/1=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK528845
Synonyms: 8- bromo- 3- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C(C)C

STK528847
Synonyms: methyl3- [({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}acetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2

STK528849
Synonyms: 2- (3,4- dichlorophenyl)- 4- [(2E)- 2- (3- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528851
Synonyms: 3- ({(E)- [4- (dimethylamino)- 2,3,5,6- tetrafluorophenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1c(/C=N/n2cnc3c(c2=O)[nH]c2c3cccc2)c(F)c(c(c1F)N(C)C)F

STK528852
Synonyms: 8- bromo- 7- [2- hydroxy- 3- (4- iodophenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Ic1ccc(cc1)OCC(Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C)O

STK528854
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- nonyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK528856
Synonyms: 1,3- dimethyl- 4- (4- methylphenyl)- 3a,6a- diphenyltetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)NC2(C1(c1ccccc1)N(C)C(=O)N2C)c1ccccc1

STK528858
Synonyms: (5Z)- 1- methyl- 5- [4- (octyloxy)benzylidene]- 3- phenylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCCCCCCCOc1ccc(cc1)/C=C\1/C(=O)N(C)C(=O)N(C1=O)c1ccccc1

STK528860
Synonyms: ethyl(2E)- 2- (1- phenylethylidene)hydrazinecarboxylate
Smiles: CCOC(=O)N/N=C(/c1ccccc1)\C

STK528862
Synonyms: 7- heptyl- 8- [(2- hydroxyethyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK528863
Synonyms: 3- [2- (4- fluorophenyl)ethyl]- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCc1ccc(cc1)F

STK528864
Synonyms: 8- (heptylsulfanyl)- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK528865
Synonyms: 4- ({(2E)- 3- (4- bromophenyl)- 2- [(phenylcarbonyl)amino]prop- 2- enoyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccccc1

STK528866
Synonyms: 3- methyl- 7- octyl- 8- (octylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCSc1nc2c(n1CCCCCCCC)c(=O)[nH]c(=O)n2C

STK528867
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 8- (hexylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCSc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C

STK528868
Synonyms: 7- [(3- hydroxypropyl)amino]- 1- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: OCCCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C

STK528869
Synonyms: 8- bromo- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK528870
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 1- (1H- indol- 3- yl)ethanone
Smiles: Fc1ccccc1N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK528872
Synonyms: 3- {[(E)- (3- iodophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Ic1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528876
Synonyms: 7- heptyl- 3- methyl- 8- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STK528877
Synonyms: 4- {(2E)- 2- [1- (3,4- dimethoxyphenyl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: COc1cc(ccc1OC)/C(=N/Nc1nc2ccccc2n2c1nnc2)/C

STK528879
Synonyms: 2- methyl- 2- [(Z)- [(5- nitrofuran- 2- yl)methylidene](oxido)- lambda~5~- azanyl]cyclohexanone
Smiles: O=C1CCCCC1(C)/[N+](=C/c1ccc(o1)[N+](=O)[O-])/[O-]

STK528880
Synonyms: 1- (1H- indol- 3- yl)- 2- (2- methylpiperidin- 1- yl)ethanone
Smiles: CC1CCCCN1CC(=O)c1c[nH]c2c1cccc2

STK528881
Synonyms: hexyl4- [(4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)amino]benzoate
Smiles: CCCCCCOC(=O)c1ccc(cc1)NC1OC(=O)c2c1ccc(c2OC)OC

STK528882
Synonyms: 3- (2,2- dichloroethenyl)- N'- [(E)- {3- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methoxyphenyl}methylidene]- 2,2- dimethylcyclopropanecarbohydrazide
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=N/NC(=O)C1C(C1(C)C)C=C(Cl)Cl

STK528884
Synonyms: 2- (2- chlorophenyl)- N- (2,5- dimethylphenyl)quinazolin- 4- amine
Smiles: Cc1ccc(c(c1)Nc1nc(nc2c1cccc2)c1ccccc1Cl)C

STK528885
Synonyms: ethyl3- [(E)- (4- benzylpiperidin- 1- yl)diazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCC(CC1)Cc1ccccc1)cccc2

STK528886
Synonyms: benzyl3- (benzylsulfanyl)- 3- (1H- indol- 3- yl)- 2- nitropropanoate
Smiles: [O-][N+](=O)C(C(c1c[nH]c2c1cccc2)SCc1ccccc1)C(=O)OCc1ccccc1

STK528887
Synonyms: 8- methoxy- 3- {[(E)- (2- methoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccccc1OC

STK528888
Synonyms: ethyl3- ({[4- (4- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)OC

STK528891
Synonyms: 6- fluoro- 1- (2- fluoroethyl)- 7- (4- methylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: FCCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK528892
Synonyms: 3- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C)O

STK528894
Synonyms: 4- (3- ethylpyridinium- 1- yl)- 5- formyl- 2- oxo- 1,3- thiazol- 3- ide
Smiles: CCc1ccc[n+](c1)c1[n-]c(=O)sc1C=O

STK528895
Synonyms: 2- (5,6- diphenyl- 1,2,4- triazin- 3- yl)- N- (naphthalen- 1- yl)hydrazinecarboxamide
Smiles: O=C(Nc1cccc2c1cccc2)NNc1nnc(c(n1)c1ccccc1)c1ccccc1

STK528896
Synonyms: 6- (2,6- dimethoxyphenoxy)- N- (furan- 2- ylmethyl)hexan- 1- amine
Smiles: COc1cccc(c1OCCCCCCNCc1ccco1)OC

STK528897
Synonyms: 4- [2- amino- 3- cyano- 4,4- bis(trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- cyclopenta[b]pyridin- 1- yl]- N- (6- methoxypyridazin- 3- yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2ccc(nn2)OC)C2=C(C1(C(F)(F)F)C(F)(F)F)CCC2

STK528898
Synonyms: 3- {[(E)- (4- methylphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528899
Synonyms: 2- (diphenylmethyl)- N- [(4- methylphenyl)sulfonyl]hydrazinecarboxamide
Smiles: O=C(NS(=O)(=O)c1ccc(cc1)C)NNC(c1ccccc1)c1ccccc1

STK528902
Synonyms: methyl5- bromo- 3- [(3,4- dihydroisoquinolin- 2(1H)- ylacetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)Br

STK528903
Synonyms: 5- cyano- 6- (hexylsulfanyl)- 2- methyl- N- phenyl- 1,4- dihydro- 4,4'- bipyridine- 3- carboxamide
Smiles: CCCCCCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1ccncc1

STK528904
Synonyms: methyl5- bromo- 3- [(thiomorpholin- 4- ylacetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cc(cc2)Br

STK528905
Synonyms: 2- (4- bromophenyl)- 1- [3- (piperidin- 1- yl)propyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1CCCN1CCCCC1)nc1c2cccc1

STK528906
Synonyms: 3- methyl- 7- (3- methylbut- 2- en- 1- yl)- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)c1nc2c(n1CC=C(C)C)c(=O)[nH]c(=O)n2C

STK528908
Synonyms: 2- {[(E)- 1H- benzimidazol- 2- ylmethylidene]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2nc3c([nH]2)cccc3)sc2c1CCCC2

STK528910
Synonyms: (2,2,2- trichloroethane- 1,1- diyl)bis- 2- methylbenzene- 4,1- diyldiacetate
Smiles: CC(=O)Oc1ccc(cc1C)C(C(Cl)(Cl)Cl)c1ccc(c(c1)C)OC(=O)C

STK528911
Synonyms: 4- ethyl- N- [(1Z)- 4,4,7- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: CCc1ccc(cc1)/N=c/1\ssc2c1c1ccc(cc1NC2(C)C)C

STK528915
Synonyms: 6- nitro- 1- [(E)- (pyridin- 2- ylimino)methyl]naphthalen- 2- ol
Smiles: Oc1ccc2c(c1/C=N/c1ccccn1)ccc(c2)[N+](=O)[O-]

STK528916
Synonyms: 3- {[(E)- (4- chlorophenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK528917
Synonyms: 2- amino- 1- (2,4- difluorophenyl)- 4,4- bis(trifluoromethyl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2)c1ccc(cc1F)F

STK528918
Synonyms: 2- {[(3,4- dichlorophenyl)carbamoyl]amino}- N- (4- methylphenyl)benzamide
Smiles: Cc1ccc(cc1)NC(=O)c1ccccc1NC(=O)Nc1ccc(c(c1)Cl)Cl

STK528919
Synonyms: 2- amino- 4- (4- butoxyphenyl)- 6- {[2- oxo- 2- (2- oxo- 2H- chromen- 3- yl)ethyl]sulfanyl}pyridine- 3,5- dicarbonitrile
Smiles: CCCCOc1ccc(cc1)c1c(C#N)c(SCC(=O)c2cc3ccccc3oc2=O)nc(c1C#N)N

STK528921
Synonyms: 3- (4- tert- butylphenoxy)- 5- oxo- 5H- anthra[1,9- cd][1,2]oxazol- 6- ylbenzoate
Smiles: O=C1C=C(Oc2ccc(cc2)C(C)(C)C)c2c3c1c(OC(=O)c1ccccc1)c1ccccc1c3on2

STK528922
Synonyms: 2- (2- chlorophenyl)- 4- {(2E)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C

STK528924
Synonyms: methyl3- {[(1- heptyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)carbonyl]amino}thiophene- 2- carboxylate
Smiles: CCCCCCCn1c(=O)c(C(=O)Nc2ccsc2C(=O)OC)c(c2c1cccc2)O

STK528925
Synonyms: 7- hexadecyl- 3- methyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCC1

STK528926
Synonyms: ethyl4- (8- methoxy- 5H- pyrimido[5,4- b]indol- 4- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)OC

STK528928
Synonyms: (2Z)- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc(cc1Cl)Cl

STK528930
Synonyms: 2,2,3,3,4,4,4- heptafluoro- N- {2- [(heptafluoropropyl)sulfanyl]phenyl}butanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1ccccc1SC(C(C(F)(F)F)(F)F)(F)F

STK528932
Synonyms: methyl5- bromo- 3- {[N- (2,2- dimethoxyethyl)- N- methylglycyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(CN(CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC)C)OC

STK528933
Synonyms: 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]c1c2cccc1

STK528934
Synonyms: methyl3- phenylimidazo[1,2- a]pyridine- 2- carboxylate
Smiles: COC(=O)c1nc2n(c1c1ccccc1)cccc2

STK528935
Synonyms: diphenyl{[4- (dimethylamino)phenyl][(3- nitrophenyl)amino]methyl}phosphonate
Smiles: CN(c1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1cccc(c1)[N+](=O)[O-])C

STK528937
Synonyms: N- decyl- N'- (4- phenyl- 1,3- thiazol- 2- yl)ethanediamide
Smiles: CCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)c1ccccc1

STK528939
Synonyms: 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1cc(Cl)c(cc1NC1OC(=O)c2c1ccc(c2OC)OC)OC

STK528941
Synonyms: (2E)- 2- {4- [4- (2- methylpropyl)phenyl]- 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)CC(C)C

STK528942
Synonyms: N- (6- methylpyridin- 2- yl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1ccc(=O)oc1

STK528943
Synonyms: 7- (3- bromobenzyl)- 1,3- dimethyl- 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)n(c(=O)n2C)C

STK528947
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- N- [(1R)- 1- phenylethyl]- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)N[C@@H](c2ccccc2)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK528953
Synonyms: 2- (2- chlorophenyl)- 4- {(2E)- 2- [1- (3,4- dimethoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1cc(ccc1OC)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C

STK528955
Synonyms: N- (4- chlorophenyl)- 2- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK528956
Synonyms: 2- tert- butyl- 1- [2- (4- methylpiperazin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: CN1CCN(CC1)CCn1c2nc3c(n2cc1C(C)(C)C)cccc3

STK528957
Synonyms: 2- [2- (4- bromophenyl)- 1H- imidazo[1,2- a]benzimidazol- 1- yl]- N,N- diethylethanamine
Smiles: CCN(CCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br)CC

STK528958
Synonyms: ethyl1- ethyl- 6- nitro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cn(CC)c2c(c1=O)cc(cc2)[N+](=O)[O-]

STK528959
Synonyms: 4- (octylsulfinyl)tetrahydrothiophene- 3- ol1,1- dioxide
Smiles: CCCCCCCCS(=O)C1CS(=O)(=O)CC1O

STK528961
Synonyms: 3- (2,6- dimethoxyphenoxy)- 2- methyl- N- (tetrahydrofuran- 2- ylmethyl)propan- 1- amine
Smiles: COc1cccc(c1OCC(CNCC1CCCO1)C)OC

STK528962
Synonyms: (2,2,2',2',4,4'- hexamethyl- 1,2,3,4- tetrahydro- 4,6'- biquinolin- 1'(2'H)- yl)(4- nitrophenyl)methanone
Smiles: CC1=CC(C)(C)N(c2c1cc(cc2)C1(C)CC(C)(C)Nc2c1cccc2)C(=O)c1ccc(cc1)[N+](=O)[O-]

STK528963
Synonyms: 1- [bis(2- hydroxyethyl)amino]- 3- (diphenylamino)propan- 2- ol
Smiles: OCCN(CC(CN(c1ccccc1)c1ccccc1)O)CCO

STK528965
Synonyms: (7E)- 7- (2- bromobenzylidene)- 3,4- diphenyl- 4H- [1,3]thiazolo[2,3- c][1,2,4]triazin- 6(7H)- one
Smiles: Brc1ccccc1/C=c\1/sc2=NN=C(C(n2c1=O)c1ccccc1)c1ccccc1

STK528966
Synonyms: (2Z)- 3- [4- (6- chloro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 2- (3,4- dichlorophenyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1scc(n1)c1cc2cc(Cl)ccc2oc1=O)/c1ccc(c(c1)Cl)Cl

STK528967
Synonyms: diphenyl{[(4- bromophenyl)amino](4- methoxyphenyl)methyl}phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccc(cc1)Br

STK528968
Synonyms: 4- (4- chlorophenoxy)- 2- (3,4- dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK528969
Synonyms: 5- [(E)- {2- [(2- hydroxyphenyl)carbonyl]hydrazinylidene}methyl]- 2- oxo- 4- [4- (phenylcarbonyl)pyridinium- 1- yl]- 1,3- thiazol- 3- ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)C(=O)c1ccccc1)/C=N/NC(=O)c1ccccc1O

STK528971
Synonyms: 2- [(3- methyl- 7- octyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]acetamide
Smiles: CCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C

STK528972
Synonyms: 1- [6- (4- fluorophenoxy)hexyl]- 4- (2- methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCCCOc1ccc(cc1)F

STK528974
Synonyms: methyl4- {[2- (4- chlorophenyl)quinazolin- 4- yl]oxy}benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK528975
Synonyms: 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(c(c1)O)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK528976
Synonyms: 6- (diethylamino)- 2- methyl- 3- (propan- 2- yl)hex- 4- yn- 3- ol
Smiles: CCN(CC#CC(C(C)C)(C(C)C)O)CC

STK528977
Synonyms: diphenyl{(4- methoxyphenyl)[(4- nitrophenyl)amino]methyl}phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK528980
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- (naphthalen- 1- ylamino)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CNc1cccc2c1cccc2

STK528981
Synonyms: 2- oxo- 5- {(E)- [2- (phenylcarbonyl)hydrazinylidene]methyl}- 4- [4- (phenylcarbonyl)pyridinium- 1- yl]- 1,3- thiazol- 3- ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)C(=O)c1ccccc1)/C=N/NC(=O)c1ccccc1

STK528983
Synonyms: 8- methyl- 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK528984
Synonyms: 1- (1- phenylcyclopentyl)- N- (4- propoxybenzyl)methanamine
Smiles: CCCOc1ccc(cc1)CNCC1(CCCC1)c1ccccc1

STK528985
Synonyms: methyl5- chloro- 3- ({[4- (ethoxycarbonyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK528986
Synonyms: 3- {[(E)- (4- fluorophenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)F

STK528988
Synonyms: ethylN- {[4- (pentyloxy)phenyl]carbonyl}glycylglycinate
Smiles: CCCCCOc1ccc(cc1)C(=O)NCC(=O)NCC(=O)OCC

STK528989
Synonyms: ethylN- [(2- chlorophenyl)carbonyl]- 2- [(2- chloropyridin- 3- yl)amino]- 3,3,3- trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1Cl)Nc1cccnc1Cl

STK528990
Synonyms: 5,5'- piperazine- 1,4- diylbis[4- nitro- 7- (piperidin- 1- yl)- 2,1,3- benzoxadiazole]
Smiles: [O-][N+](=O)c1c(cc(c2c1non2)N1CCCCC1)N1CCN(CC1)c1cc(N2CCCCC2)c2c(c1[N+](=O)[O-])non2

STK528991
Synonyms: 3- (1- methyl- 5- oxo- 2- thioxoimidazolidin- 4- yl)propanamide
Smiles: CN1C(=O)C(NC1=S)CCC(=O)N

STK528992
Synonyms: (5E)- 3- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- thioxo- 5- ({5- [3- (trifluoromethyl)phenyl]furan- 2- yl}methylidene)- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C/c2ccc(o2)c2cccc(c2)C(F)(F)F)/C(=O)N1C1CCS(=O)(=O)C1

STK528993
Synonyms: 1,7- dibenzyl- 3- methyl- 8- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK528994
Synonyms: methyl3- ({[4- (2- hydroxyethyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: OCCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK528995
Synonyms: 3- ({(E)- [4- (prop- 2- en- 1- yloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK528996
Synonyms: ethyl5- fluoro- 3- {[(4- methylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C)cc(cc2)F

STK528997
Synonyms: 4- chloro- 2- (methylsulfanyl)- 6- (propan- 2- ylamino)pyrimidine- 5- carbonitrile
Smiles: CSc1nc(NC(C)C)c(c(n1)Cl)C#N

STK528998
Synonyms: methyl3- ({[(3S)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK529002
Synonyms: ethyl5- fluoro- 3- {[(2- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)F

STK529005
Synonyms: 3- {[(E)- (4- chlorophenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)Cl

STK529006
Synonyms: 4,4'- (phenylmethanediyl)bis(1- hexyl- 3- methyl- 1H- pyrazol- 5- ol)
Smiles: CCCCCCn1nc(c(c1O)C(c1c(C)nn(c1O)CCCCCC)c1ccccc1)C

STK529007
Synonyms: ({7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 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)COc1ccccc1C

STK529008
Synonyms: 8- bromo- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

STK529009
Synonyms: 5- {[(1S,2S)- 2- chlorocyclopentyl]sulfanyl}- 2- phenyl- 2H- tetrazole
Smiles: Cl[C@H]1CCC[C@@H]1Sc1nnn(n1)c1ccccc1

STK529010
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 1- (5- methyl- 2,3- diphenyl- 1H- indol- 1- yl)butan- 2- ol
Smiles: Cc1ccc2c(c1)c(c1ccccc1)c(n2CC(CCN1CCN(CC1)Cc1ccccc1)O)c1ccccc1

STK529011
Synonyms: N- (2- chlorobenzyl)- 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)NCc1ccccc1Cl

STK529012
Synonyms: 2- [(E)- ({2- [(2- methylphenyl)amino]- 1- benzofuran- 3- yl}imino)methyl]phenol
Smiles: Cc1ccccc1Nc1oc2c(c1/N=C/c1ccccc1O)cccc2

STK529013
Synonyms: ethyl3- [(3,4- dihydroisoquinolin- 2(1H)- ylacetyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)F

STK529015
Synonyms: 2- amino- N- (4- chlorophenyl)- 3,5- dinitrobenzamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc(cc(c1N)[N+](=O)[O-])[N+](=O)[O-]

STK529017
Synonyms: methyl5- bromo- 3- {[(3- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)Br

STK529018
Synonyms: methyl5- methyl- 3- [(thiomorpholin- 4- ylacetyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cc(cc2)C

STK529019
Synonyms: N- (4- bromophenyl)- 2- (3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK529020
Synonyms: 4- [2- (2,6- dimethoxyphenoxy)ethyl]thiomorpholine
Smiles: COc1cccc(c1OCCN1CCSCC1)OC

STK529021
Synonyms: 6- bromo- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)quinoline- 4- carboxylicacid
Smiles: Brc1ccc2c(c1)c(cc(n2)C12CC3CC(C2)CC(C1)C3)C(=O)O

STK529024
Synonyms: bis[3- amino- 4- (dimethylamino)phenyl]methanone
Smiles: O=C(c1ccc(c(c1)N)N(C)C)c1ccc(c(c1)N)N(C)C

STK529025
Synonyms: 5- (4- hydroxyphenyl)- 3,4,5,6- tetrahydrobenzo[a]phenanthridin- 1(2H)- one
Smiles: Oc1ccc(cc1)C1Nc2ccc3c(c2C2=C1CCCC2=O)cccc3

STK529027
Synonyms: N- [(3Z)- 2- methyl- 3- (phenylamino)- 3- (phenylimino)propyl]- N- phenyltridecanamide
Smiles: CCCCCCCCCCCCC(=O)N(c1ccccc1)CC(/C(=N/c1ccccc1)/Nc1ccccc1)C

STK529028
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK529029
Synonyms: ethyl3,3,3- trifluoro- N- ({2- [(4- methylphenyl)sulfonyl]hydrazinyl}carbonyl)- 2- phenoxyalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Oc1ccccc1)NC(=O)NNS(=O)(=O)c1ccc(cc1)C

STK529030
Synonyms: 2- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)- N- {1- [(1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)acetyl]- 1,2,3,4- tetrahydroquinolin- 4- yl}- N- phenylacetamide
Smiles: O=C(N1CCC(c2c1cccc2)N(C(=O)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)c1ccccc1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

STK529031
Synonyms: N'- [(E)- (1,3- diphenyl- 1H- pyrazol- 4- yl)methylidene]- N- (4- oxo- 3- phenyl- 3,4- dihydroquinazolin- 2- yl)acetohydrazide
Smiles: CC(=O)N(c1nc2ccccc2c(=O)n1c1ccccc1)/N=C/c1cn(nc1c1ccccc1)c1ccccc1

STK529033
Synonyms: 3- decyl- 1- methyl- 9- phenyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCCCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccccc1

STK529034
Synonyms: N- {2- [(3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}benzamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccccc1

STK529035
Synonyms: 10- (3- hydroxyphenyl)- 3,3,6,6- tetramethyl- 3,4,6,7,9,10- hexahydroacridine- 1,8(2H,5H)- dione
Smiles: Oc1cccc(c1)N1C2=C(CC3=C1CC(C)(C)CC3=O)C(=O)CC(C2)(C)C

STK529038
Synonyms: 4- (2,4- dimethylphenyl)- 2- [(2- methylpropanoyl)amino]thiophene- 3- carboxylicacid
Smiles: O=C(C(C)C)Nc1scc(c1C(=O)O)c1ccc(cc1C)C

STK529039
Synonyms: 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK529040
Synonyms: 4- (azepan- 1- yl)- 2- (2- chlorophenyl)quinazoline
Smiles: Clc1ccccc1c1nc(N2CCCCCC2)c2c(n1)cccc2

STK529041
Synonyms: ethyl6,7- difluoro- 1- hexyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F

STK529042
Synonyms: ethyl[(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl](oxo)acetate
Smiles: CCOC(=O)C(=O)N/N=C/c1ccc(c(c1)OC)OC

STK529044
Synonyms: 2- (2- chlorophenyl)- N- (2,5- dimethoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccc(c(c1)Nc1nc(nc2c1cccc2)c1ccccc1Cl)OC

STK529045
Synonyms: N'- [(1E)- 1- (6- chloro- 2- oxo- 2H- chromen- 3- yl)ethylidene]pyridine- 4- carbohydrazide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccncc1)/C

STK529046
Synonyms: 1,1'- {4- methyl- 6- [methyl(nitroso)amino]benzene- 1,3- diyl}diethanone
Smiles: O=NN(c1cc(C)c(cc1C(=O)C)C(=O)C)C

STK529049
Synonyms: N,N- dimethyl- 4- [(3- methyl- 9H- carbazol- 9- yl)methyl]aniline
Smiles: Cc1ccc2c(c1)c1ccccc1n2Cc1ccc(cc1)N(C)C

STK529050
Synonyms: (1E)- N,N- dimethyl- N'- [(4- methylphenyl)sulfonyl]ethanimidamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=C(/N(C)C)\C

STK529051
Synonyms: 2- butyl4- methyl3,5- dimethyl- 1H- pyrrole- 2,4- dicarboxylate
Smiles: CCCCOC(=O)c1[nH]c(c(c1C)C(=O)OC)C

STK529052
Synonyms: 4- hydrazinyl- 2- phenyl- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclopentane]
Smiles: NNc1nc(nc2c1C1(CCCC1)Cc1c2cccc1)c1ccccc1

STK529054
Synonyms: (2E)- 3- [(2- iodophenyl)amino]- 2- [4- (6- nitro- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK529055
Synonyms: 2- (4- benzylpiperidin- 1- yl)- 1- (5- methoxy- 1H- indol- 3- yl)ethanol
Smiles: COc1ccc2c(c1)c(c[nH]2)C(CN1CCC(CC1)Cc1ccccc1)O

STK529056
Synonyms: 3- (4- chloro- 3- fluorophenyl)- 1- (5- methyl- 4,5- dihydro- 1,3- thiazol- 2- yl)- 1- (4- methylphenyl)urea
Smiles: CC1CN=C(S1)N(c1ccc(cc1)C)C(=O)Nc1ccc(c(c1)F)Cl

STK529059
Synonyms: ethyl5- methoxy- 3- [(E)- thiomorpholin- 4- yldiazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCSCC1)cc(cc2)OC

STK529060
Synonyms: methyl5- methyl- 3- ({[4- (3- methyl- 2,6- dioxo- 7- propyl- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK529062
Synonyms: 8- methoxy- 3- ({(E)- [4- (octyloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK529063
Synonyms: ethyl3- {(E)- [4- (diphenylmethyl)piperazin- 1- yl]diazenyl}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)C(c1ccccc1)c1ccccc1)cc(cc2)OC

STK529066
Synonyms: 4- {(2E)- 2- [1- (4- bromophenyl)ethylidene]hydrazinyl}- 2- (3,4- dichlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)/C

STK529067
Synonyms: 2- [(2E)- 2- (2- fluorobenzylidene)hydrazinyl]- 3- methylquinoxaline
Smiles: Cc1nc2ccccc2nc1N/N=C/c1ccccc1F

STK529068
Synonyms: ethylN- [(3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)carbamoyl]- 3,3,3- trifluoro- 2- (2,2,2- trifluoroethoxy)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)Nc1sc(c(c1C#N)CC)C)OCC(F)(F)F

STK529069
Synonyms: 8- methyl- 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]

STK529070
Synonyms: ethyl2- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2c(O)ccc3c2cccc3)sc2c1CCN(C2)C

STK529071
Synonyms: 7- {[2- (3,4- dichlorophenyl)- 2- oxoethyl]sulfanyl}- 9- oxo- 8- azaspiro[4.5]dec- 6- ene- 6,10- dicarbonitrile
Smiles: N#CC1C(=O)NC(=C(C21CCCC2)C#N)SCC(=O)c1ccc(c(c1)Cl)Cl

STK529073
Synonyms: ethyl3- amino- 1- (2- chlorophenyl)- 1H- benzo[f]chromene- 2- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccccc1Cl)c1ccccc1cc2

STK529074
Synonyms: ethyl4- ({N- [(4- butoxyphenyl)carbonyl]- beta- alanyl}amino)butanoate
Smiles: CCCCOc1ccc(cc1)C(=O)NCCC(=O)NCCCC(=O)OCC

STK529075
Synonyms: 7- hexadecyl- 8- (hexylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK529076
Synonyms: 2,2,2- trichloro- 1- {[4- (phenoxymethyl)- 6- ({2,2,2- trichloro- 1- [(phenylcarbamoyl)oxy]ethyl}amino)- 1,3,5- triazin- 2- yl]amino}ethyl(4- chlorophenyl)carbamate
Smiles: O=C(OC(C(Cl)(Cl)Cl)Nc1nc(nc(n1)COc1ccccc1)NC(C(Cl)(Cl)Cl)OC(=O)Nc1ccccc1)Nc1ccc(cc1)Cl

STK529077
Synonyms: methyl2,4- dimethyl- 5- [(E)- (naphthalen- 1- ylimino)methyl]- 1H- pyrrole- 3- carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1C)/C=N/c1cccc2c1cccc2

STK529078
Synonyms: 2- ethyl- 6- [(4- fluorophenyl)carbonyl]- 5,11- dihydro- 4H- thieno[3',2':5,6]pyrimido[1,2- b]isoquinolin- 4- one
Smiles: CCc1cc2c(s1)n1Cc3ccccc3C(=c1[nH]c2=O)C(=O)c1ccc(cc1)F

STK529079
Synonyms: ethyl3- ({[3- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC

STK529080
Synonyms: 7- decyl- 8- [(2- hydroxypropyl)sulfanyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCn1c(SCC(O)C)nc2c1c(=O)[nH]c(=O)n2C

STK529082
Synonyms: 7- benzyl- 8- (dodecylsulfanyl)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK529083
Synonyms: N- (2,4- dimethyl- 5- nitrophenyl)- 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)Nc1cc([N+](=O)[O-])c(cc1C)C)C

STK529085
Synonyms: 1,7- dibenzyl- 8- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK529086
Synonyms: 3,6- diphenyl- 9- [4- (propan- 2- yloxy)phenyl]- 3,4,5,6,7,9- hexahydro- 1H- xanthene- 1,8(2H)- dione
Smiles: CC(Oc1ccc(cc1)C1C2=C(OC3=C1C(=O)CC(C3)c1ccccc1)CC(CC2=O)c1ccccc1)C

STK529088
Synonyms: (3aS,6aS)- 3- (diphenylacetyl)- 5- [2- (trifluoromethyl)phenyl]- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: O=C(C1=NN[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)C(c1ccccc1)c1ccccc1

STK529090
Synonyms: methyl5- chloro- 3- {[(2- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)Cl

STK529092
Synonyms: 8- bromo- 3- {[(E)- pyridin- 3- ylmethylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccnc1

STK529093
Synonyms: N,N- diethyl- 4- {[(triethylstannanyl)oxy]carbonyl}benzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)C(=O)O[Sn](CC)(CC)CC)CC

STK529094
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (2- nitrobenzylidene)hydrazinyl]quinazoline
Smiles: Clc1ccccc1c1nc(N/N=C/c2ccccc2[N+](=O)[O-])c2c(n1)cccc2

STK529096
Synonyms: 1,5- bis(4- methylphenyl)- 3,7- diphenyl- 1,5,3,7- diazadiphosphocane
Smiles: Cc1ccc(cc1)N1CP(CN(CP(C1)c1ccccc1)c1ccc(cc1)C)c1ccccc1

STK529097
Synonyms: (2E)- 2- [4- (2,4- dimethylphenyl)- 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(cc1C)C

STK529099
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (3- ethoxy- 4- hydroxyphenyl)prop- 2- enenitrile
Smiles: CCOc1cc(ccc1O)/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N

STK529102
Synonyms: 3- (3- bromopropyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: BrCCCn1cnc2c(c1=O)[nH]c1c2cccc1

STK529103
Synonyms: ethyl3- amino- 1- (4- hydroxy- 3- methoxyphenyl)- 1H- benzo[f]chromene- 2- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc(c(c1)OC)O)c1ccccc1cc2

STK529105
Synonyms: N- (4- bromophenyl)- 2- (2,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK529106
Synonyms: (7,7- dimethyl- 2- {2- [(2- phenylquinolin- 4- yl)carbonyl]hydrazinylidene}bicyclo[2.2.1]hept- 1- yl)methanesulfonicacid
Smiles: O=C(c1cc(nc2c1cccc2)c1ccccc1)N/N=C/1\CC2C(C1(CC2)CS(=O)(=O)O)(C)C

STK529108
Synonyms: 7- {4- [(3- chlorophenyl)carbonyl]piperazin- 1- yl}- 1- cyclopropyl- 6- fluoro- 4- oxo- N- (pyridin- 4- ylmethyl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1F)C(=O)NCc1ccncc1)C1CC1

STK529109
Synonyms: 4- [(7- chloro- 4- nitro- 2,1,3- benzoxadiazol- 5- yl)amino]benzoicacid
Smiles: [O-][N+](=O)c1c(Nc2ccc(cc2)C(=O)O)cc(c2c1non2)Cl

STK529110
Synonyms: 1- (9- methyl- 9H- carbazol- 3- yl)propan- 1- one
Smiles: CCC(=O)c1ccc2c(c1)c1ccccc1n2C

STK529112
Synonyms: methyl5- chloro- 3- ({[4- (4- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)Cl

STK529113
Synonyms: 4- (biphenyl- 4- yloxy)- 2- (2- chlorophenyl)quinazoline
Smiles: Clc1ccccc1c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2

STK529114
Synonyms: (2E)- 3- phenyl- 1- [2,2,4- trimethyl- 4- (4- methylphenyl)- 6- trityl- 3,4- dihydroquinolin- 1(2H)- yl]prop- 2- en- 1- one
Smiles: Cc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cc(cc2)C(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)/C=C/c1ccccc1

STK529116
Synonyms: 2,3- diphenyl- 5,6,7,8- tetrahydroquinoxaline1,4- dioxide
Smiles: [O-][n+]1c(c2ccccc2)c(c2ccccc2)[n+](c2c1CCCC2)[O-]

STK529117
Synonyms: 2- methyl- 3- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]quinoxaline
Smiles: Cc1nc2ccccc2nc1N/N=C/c1cccc(c1)[N+](=O)[O-]

STK529119
Synonyms: 6- bromo- N'- [(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylidene]- 2- (thiophen- 2- yl)quinoline- 4- carbohydrazide
Smiles: Brc1ccc2c(c1)c(cc(n2)c1cccs1)C(=O)N/N=C/1\CCCc2c1non2

STK529121
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- N- hexyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK529122
Synonyms: (2Z)- N- (4- methoxybenzyl)- 2- (1- phenylethylidene)hydrazinecarbothioamide
Smiles: COc1ccc(cc1)CNC(=S)N/N=C(\c1ccccc1)/C

STK529123
Synonyms: 4- [(3- amino- 3- oxopropanoyl)amino]benzoicacid
Smiles: NC(=O)CC(=O)Nc1ccc(cc1)C(=O)O

STK529124
Synonyms: 3- ({(E)- [2- hydroxy- 3- (prop- 2- en- 1- yl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK529126
Synonyms: 8- chloro- 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCC1=CCCCC1

STK529127
Synonyms: 8- bromo- 3- (3,5- dimethoxybenzyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(cc(c1)OC)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK529129
Synonyms: N- (2,2- dimethylpropanoyl)glycylmethionine
Smiles: CSCCC(C(=O)O)NC(=O)CNC(=O)C(C)(C)C

STK529130
Synonyms: 2- phenyl- 1- [3- (pyrrolidin- 1- yl)propyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: c1ccc(cc1)c1cn2c(n1CCCN1CCCC1)nc1c2cccc1

STK529131
Synonyms: 3- imino- 1- methyl- 5,7- diphenyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccccc1)(C(C2(C#N)C#N)c1ccccc1)C

STK529132
Synonyms: 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 6- (prop- 2- en- 1- ylsulfanyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: C=CCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1cccs1

STK529133
Synonyms: 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 8- methyl- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: Oc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C

STK529134
Synonyms: methyl3- ({3- [4- (2,3- dimethylphenyl)piperazin- 1- yl]propanoyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1C)C)cc(cc2)C

STK529137
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCC(CC1)Cc1ccccc1

STK529138
Synonyms: 4- [(2E)- 2- benzylidenehydrazinyl]- 2- (4- chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2)c2c(n1)cccc2

STK529140
Synonyms: 8- bromo- 3- ({(E)- [4- (dimethylamino)- 2,3,5,6- tetrafluorophenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1c(F)c(F)c(c(c1F)F)N(C)C

STK529143
Synonyms: morpholin- 4- yl{3- [(E)- 2- (morpholin- 4- yl)ethenyl]- 2- nitrophenyl}methanone
Smiles: O=C(c1cccc(c1[N+](=O)[O-])/C=C/N1CCOCC1)N1CCOCC1

STK529144
Synonyms: 3- [(2- ethoxyphenyl)amino]- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: CCOc1ccccc1NC1OC(=O)c2c1ccc(c2OC)OC

STK529145
Synonyms: 3- {[(E)- (3- chlorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK529146
Synonyms: 3,3'- [(4- ethoxyphenyl)methanediyl]bis(2- phenyl- 1H- indole)
Smiles: CCOc1ccc(cc1)C(c1c([nH]c2c1cccc2)c1ccccc1)c1c([nH]c2c1cccc2)c1ccccc1

STK529147
Synonyms: 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 8- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)OCC(Cn1c(N/N=C/c2ccc(cc2)OC)nc2c1c(=O)[nH]c(=O)n2C)O

STK529149
Synonyms: (2E)- 2- [4- (3- nitrophenyl)- 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)c1cccc(c1)[N+](=O)[O-]

STK529153
Synonyms: 2,2- dimethyl- 5- nitro- 2H- benzimidazol- 4- amine3- oxide
Smiles: CC1(C)N=c2c(=[N+]1[O-])c(N)c(cc2)[N+](=O)[O-]

STK529154
Synonyms: N- (3- bromo- 4- methylphenyl)- 4- nitro- 7- (piperidin- 1- yl)- 2,1,3- benzoxadiazol- 5- amine
Smiles: [O-][N+](=O)c1c(Nc2ccc(c(c2)Br)C)cc(c2c1non2)N1CCCCC1

STK529155
Synonyms: 2- {[5- acetyl- 3- cyano- 6- methyl- 4- (2- methylpropyl)- 1,4- dihydropyridin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)N)NC(=C(C1CC(C)C)C(=O)C)C

STK529158
Synonyms: 1- ethyl- N- (2- hexyl- 4- oxoquinazolin- 3(4H)- yl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)CC

STK529159
Synonyms: N- heptyl- N'- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- thiazol- 2- yl]ethanediamide
Smiles: CCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3

STK529161
Synonyms: (2Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (2- methylphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1C)/c1scc(n1)c1ccc2c(c1)OCO2

STK529162
Synonyms: N- [(1E)- 1- (3,4- dimethoxyphenyl)- 3- {(2E)- 2- [1- (3,4- dimethoxyphenyl)ethylidene]hydrazinyl}- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: COc1ccc(cc1OC)/C=C(\C(=O)N/N=C(/c1ccc(c(c1)OC)OC)\C)/NC(=O)c1ccccc1

STK529164
Synonyms: methyl5- chloro- 3- {[N- (2,2- dimethoxyethyl)- N- methylglycyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(CN(CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C)OC

STK529165
Synonyms: 7- hexadecyl- 3- methyl- 8- (propylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCC)nc2c1c(=O)[nH]c(=O)n2C

STK529166
Synonyms: 2- {2- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 1,3- thiazol- 4- yl}- 3H- benzo[f]chromen- 3- one
Smiles: O=c1oc2ccc3c(c2cc1c1csc(n1)N/N=C/c1ccc(cc1)[N+](=O)[O-])cccc3

STK529167
Synonyms: ethyl2- oxo- 4- (pentylamino)- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC

STK529168
Synonyms: methyl3- {[(2- ethylpiperidin- 1- yl)acetyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: CCC1CCCCN1CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK529169
Synonyms: 6- chloro- 3- (3- chloropropanoyl)- 1,3- benzoxazol- 2(3H)- one
Smiles: ClCCC(=O)n1c(=O)oc2c1ccc(c2)Cl

STK529171
Synonyms: 4- (4- chlorophenoxy)- 2- (2,4- dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK529172
Synonyms: (3E)- 3- [(5- bromofuran- 2- yl)methylidene]- 5- (2- methylpropyl)furan- 2(3H)- one
Smiles: CC(CC1=C/C(=C\c2ccc(o2)Br)/C(=O)O1)C

STK529174
Synonyms: 8- methoxy- 3- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C(C)C

STK529175
Synonyms: 7- (2- fluorophenyl)- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: Fc1ccccc1C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK529176
Synonyms: 1- (2- methoxyphenyl)- 4- [6- (naphthalen- 1- yloxy)hexyl]piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCCCOc1cccc2c1cccc2

STK529177
Synonyms: 6- (4- ethylphenyl)- 2,3- diphenylimidazo[1,2- b][1,2,4]triazine
Smiles: CCc1ccc(cc1)c1nc2n(c1)nc(c(n2)c1ccccc1)c1ccccc1

STK529179
Synonyms: methyl3- ({[4- (ethoxycarbonyl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK529181
Synonyms: N- {2- [(3- chloro- 2- methylphenyl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1cccc(c1C)Cl

STK529182
Synonyms: N,2- bis(3,4- dichlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1Cl)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK529183
Synonyms: 3- (pyridin- 4- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccncc1

STK529184
Synonyms: 3- (morpholin- 4- yl)- 2- phenyl- 1- (4- propoxyphenyl)propan- 1- one
Smiles: CCCOc1ccc(cc1)C(=O)C(c1ccccc1)CN1CCOCC1

STK529185
Synonyms: 8- (heptylsulfanyl)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCSc1nc2c(n1CCCCCCCC)c(=O)[nH]c(=O)n2C

STK529186
Synonyms: 2- [(7- hexadecyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]- N- phenylacetamide
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK529188
Synonyms: 3- {[(E)- (4- methoxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK529189
Synonyms: (3Z)- 2- (diphenylacetyl)- 3- {(2E)- [(2E)- 3- phenylprop- 2- en- 1- ylidene]hydrazinylidene}- 2,3- dihydro- 1H- inden- 1- one
Smiles: O=C1c2ccccc2/C(=N\N=C\C=C\c2ccccc2)/C1C(=O)C(c1ccccc1)c1ccccc1

STK529190
Synonyms: 2- (2- chlorophenyl)- N- (3- chlorophenyl)quinazolin- 4- amine
Smiles: Clc1cccc(c1)Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK529191
Synonyms: 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cccc(c1O)OC

STK529193
Synonyms: N- (4- methoxyphenyl)- 2- [(2- methylpropanoyl)amino]- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(NC(=O)C(C)C)sc2c1CCC2

STK529194
Synonyms: ethyl3,3,3- trifluoro- N- (furan- 2- ylcarbonyl)- 2- [(2- methoxyphenyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1ccccc1OC)NC(=O)c1ccco1

STK529195
Synonyms: N- [4- (1,3- dioxo- 2,3- dihydro- 1H- inden- 2- yl)phenyl]pentanamide
Smiles: CCCCC(=O)Nc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2

STK529197
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1C)[N+](=O)[O-])/C#N

STK529199
Synonyms: 2- [(E)- {2- [2- (2- chlorophenyl)quinazolin- 4- yl]hydrazinylidene}methyl]- 6- methoxyphenol
Smiles: COc1cccc(c1O)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK529201
Synonyms: 3,3'- [benzene- 1,4- diylbis(oxy)]bis[1- (piperidin- 1- yl)propan- 2- ol]
Smiles: OC(CN1CCCCC1)COc1ccc(cc1)OCC(CN1CCCCC1)O

STK529202
Synonyms: (5E)- 3- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 5- (2- hydroxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Oc1ccccc1/C=C\1/SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C

STK529203
Synonyms: 3- chloro- N- [(1Z)- 8- methoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]- 2- methylaniline
Smiles: COc1ccc2c(c1)c1/c(=N/c3cccc(c3C)Cl)/ssc1C(N2)(C)C

STK529205
Synonyms: methyl5- chloro- 3- ({[4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK529206
Synonyms: 5- (anthracen- 9- ylmethyl)- 1,3- dimethyl- 5- {[(1R,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]methyl}- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: S=C1N(C)C(=O)C(C(=O)N1C)(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1c2ccccc2cc2c1cccc2

STK529207
Synonyms: 1,1'- (2,3,8- trimethyl- 5,6- dihydrodipyrrolo[1,2- a:2',1'- c]pyrazine- 1,10- diyl)bis(trifluoroethanone)
Smiles: Cc1cc(c2n1CCn1c2c(c(c1C)C)C(=O)C(F)(F)F)C(=O)C(F)(F)F

STK529208
Synonyms: (2Z)- 3- phenyl- 2- {4- [4- (phenylsulfanyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1)/c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK529209
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 2- (4- bromophenyl)quinazoline
Smiles: Brc1ccc(cc1)c1nc(N2CCC(CC2)Cc2ccccc2)c2c(n1)cccc2

STK529210
Synonyms: 2- (butylsulfanyl)- 5- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 6- hydroxy- 3- phenylpyrimidin- 4(3H)- one
Smiles: CCCCSc1nc(O)c(c(=O)n1c1ccccc1)C1OC(=O)c2c1ccc(c2OC)OC

STK529211
Synonyms: 2- ethyl- N- [(1Z)- 4,4,6- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1cccc(c1NC2(C)C)C

STK529212
Synonyms: 2- {[(E)- furan- 2- ylmethylidene]amino}- 6- methyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carbonitrile
Smiles: N#Cc1c(/N=C/c2ccco2)sc2c1CCN(C2)C

STK529214
Synonyms: methyl5- methyl- 3- [(3- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}propanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)C

STK529218
Synonyms: 1,3,4,5- tetraphenyl- 1,4- dihydro- 1,2,4- diazaphosphinine4- sulfide
Smiles: S=P1(c2ccccc2)C(=CN(N=C1c1ccccc1)c1ccccc1)c1ccccc1

STK529220
Synonyms: 2- benzyl- 4- (methylsulfanyl)- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclohexane]
Smiles: CSc1nc(Cc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1

STK529221
Synonyms: 8- (benzylsulfanyl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK529222
Synonyms: methyl4,6- bis(dimethylamino)- 1,3,5- triazine- 2- carboxylate
Smiles: COC(=O)c1nc(nc(n1)N(C)C)N(C)C

STK529223
Synonyms: 2,2'- (1,3,4- thiadiazole- 2,5- diyldisulfanediyl)bis(N'- {(E)- [4- (dimethylamino)phenyl]methylidene}acetohydrazide)
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(s1)SCC(=O)N/N=C/c1ccc(cc1)N(C)C)C

STK529225
Synonyms: 2- (8- methyl- 3- oxo- 8- phenylhexahydro- 7H- [1,3]thiazolo[3,2- a]pyrazin- 7- yl)acetohydrazide
Smiles: NNC(=O)CN1CCN2C(C1(C)c1ccccc1)SCC2=O

STK529226
Synonyms: ethyl[(E)- (4- bromophenyl)diazenyl][(ethylsulfanyl)(phenyl)phosphoryl]acetate
Smiles: CCOC(=O)C(P(=O)(c1ccccc1)SCC)/N=N/c1ccc(cc1)Br

STK529229
Synonyms: methyl5- methyl- 3- [(E)- (4- phenylpiperazin- 1- yl)diazenyl]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccccc1)cc(cc2)C

STK529230
Synonyms: methyl{3- [4,6- bis(dimethylamino)- 1,3,5- triazin- 2- yl]- 2,5- dioxoimidazolidin- 1- yl}acetate
Smiles: COC(=O)CN1C(=O)CN(C1=O)c1nc(nc(n1)N(C)C)N(C)C

STK529231
Synonyms: (5E)- 5- {[5- (4- bromophenyl)furan- 2- yl]methylidene}- 3- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C

STK529233
Synonyms: 8- methoxy- 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK529234
Synonyms: 4- (2- methylpropoxy)- N- {(1E)- 3- [(4- nitrophenyl)amino]- 3- oxo- 1- phenylprop- 1- en- 2- yl}benzamide
Smiles: CC(COc1ccc(cc1)C(=O)N/C(=C/c1ccccc1)/C(=O)Nc1ccc(cc1)[N+](=O)[O-])C

STK529236
Synonyms: dipropan- 2- yl(1- bromo- 2- oxoethyl)phosphonate
Smiles: O=CC(P(=O)(OC(C)C)OC(C)C)Br

STK529237
Synonyms: 4- [4- (diphenylmethyl)piperazin- 1- yl]- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK529238
Synonyms: 2- (3,3- dimethylpiperidin- 1- yl)- 1- (1H- indol- 3- yl)ethanol
Smiles: OC(c1c[nH]c2c1cccc2)CN1CCCC(C1)(C)C

STK529239
Synonyms: diethyl2,2'- (8- bromo- 3- methyl- 2,6- dioxo- 3,6- dihydro- 1H- purine- 1,7(2H)- diyl)diacetate
Smiles: CCOC(=O)Cn1c(Br)nc2c1c(=O)n(CC(=O)OCC)c(=O)n2C

STK529240
Synonyms: 3,3'- [benzene- 1,4- diylbis(oxy)]bis[1- (diethylamino)propan- 2- ol]
Smiles: CCN(CC(COc1ccc(cc1)OCC(CN(CC)CC)O)O)CC

STK529241
Synonyms: 3- methyl- 1- phenyl- 6- (piperidin- 1- yl)- 4,4- bis(trifluoromethyl)- 1,4- dihydropyrazolo[4,3- e][1,3]oxazine
Smiles: Cc1nn(c2c1C(N=C(O2)N1CCCCC1)(C(F)(F)F)C(F)(F)F)c1ccccc1

STK529242
Synonyms: methyl3- {[(4- benzylpiperazin- 1- yl)acetyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)OC

STK529243
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1- (1H- indol- 3- yl)ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

STK529245
Synonyms: 2- (2,4- dichlorophenyl)- 4- [(2E)- 2- (2- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK529248
Synonyms: N'- [(3E)- 5- bromo- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]- 3,4- dimethoxybenzohydrazide
Smiles: COc1cc(ccc1OC)C(=O)N/N=C/1\c2cc(Br)ccc2N(C1=O)CN1CCCCC1c1cccnc1

STK529249
Synonyms: 1- [2- (2,6- dimethoxyphenoxy)ethyl]- 4- (diphenylmethyl)piperazine
Smiles: COc1cccc(c1OCCN1CCN(CC1)C(c1ccccc1)c1ccccc1)OC

STK529250
Synonyms: 6- bromo- 2- [(2E)- 2- (furan- 2- ylmethylidene)hydrazinyl]- 4- phenylquinoline
Smiles: Brc1ccc2c(c1)c(cc(n2)N/N=C/c1ccco1)c1ccccc1

STK529251
Synonyms: (2,4,5,6- tetrabromobenzene- 1,3- diyl)dimethanol
Smiles: OCc1c(Br)c(CO)c(c(c1Br)Br)Br

STK529253
Synonyms: 1- (3,4- dichlorophenyl)- 2- (3- hexadecyl- 2- imino- 2,3- dihydro- 1H- benzimidazol- 1- yl)ethanone
Smiles: CCCCCCCCCCCCCCCCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(c(c1)Cl)Cl

STK529254
Synonyms: 2- tert- butyl- 9- (prop- 2- en- 1- yl)- 9H- imidazo[1,2- a]benzimidazole
Smiles: C=CCn1c2nc(cn2c2c1cccc2)C(C)(C)C

STK529255
Synonyms: ethyl5- methoxy- 3- [(E)- (4- phenylpiperazin- 1- yl)diazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccccc1)cc(cc2)OC

STK529257
Synonyms: 2- (2,4- dichlorophenyl)- 4- (propan- 2- yloxy)quinazoline
Smiles: CC(Oc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)C

STK529258
Synonyms: 8- bromo- 3- ({(E)- [4- (3,5- diphenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccccc1

STK529260
Synonyms: 4- [(2,4- dimethylphenyl)amino]- 4- oxo- 3- (tetrahydrofuran- 2- yl)butanoicacid
Smiles: OC(=O)CC(C(=O)Nc1ccc(cc1C)C)C1CCCO1

STK529261
Synonyms: hexadecyl(2E)- 3- [5- (4- bromophenyl)furan- 2- yl]- 2- cyanoprop- 2- enoate
Smiles: CCCCCCCCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N

STK529263
Synonyms: [1- {bis[2- (hydroxy- kappaO)ethyl]amino- kappaN}- 3- butoxypropan- 2- olato(3- )- kappaO]boron
Smiles: CCCCOCC1O[B-]23[N+](C1)(CCO3)CCO2

STK529264
Synonyms: 9,11- diphenyl- 8,11- dihydronaphtho[1',2':4,5]imidazo[2,1- c][1,2,4]triazine
Smiles: c1ccc(cc1)N1N=C(Cn2c1nc1c2ccc2c1cccc2)c1ccccc1

STK529266
Synonyms: 1- (3- fluoro- 4- methoxyphenyl)- 2- phenyl- 3- (pyrrolidin- 1- yl)propan- 1- one
Smiles: COc1ccc(cc1F)C(=O)C(c1ccccc1)CN1CCCC1

STK529268
Synonyms: N'- benzyl- 2- (diethylamino)- N'- phenylacetohydrazide(non- preferredname)
Smiles: CCN(CC(=O)NN(c1ccccc1)Cc1ccccc1)CC

STK529270
Synonyms: 2- (2,4- dichlorophenyl)- 4- (2- methylphenoxy)quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(Oc2ccccc2C)c2c(n1)cccc2

STK529272
Synonyms: (2E)- 2- [4- (3,4- dimethylphenyl)- 1,3- thiazol- 2- yl]- 3- [(2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)C)C

STK529273
Synonyms: 7- {[2- (cyclohex- 1- en- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3ccccc3oc1cc2NCCC1=CCCCC1

STK529275
Synonyms: N- benzyl- 2- (4- chlorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(NCc2ccccc2)c2c(n1)cccc2

STK529276
Synonyms: 8- (benzylsulfanyl)- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK529277
Synonyms: 1- (1H- indol- 3- yl)- 2- [4- (2- methoxyphenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccccc1N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2

STK529278
Synonyms: ethyl5- methoxy- 3- {[3- (morpholin- 4- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCOCC1)cc(cc2)OC

STK529280
Synonyms: (2Z)- 2- (3- bromo- 2- hydroxybenzylidene)- 6,7- dimethyl[1,3]thiazolo[3,2- a]benzimidazol- 3(2H)- one
Smiles: Cc1cc2nc3n(c2cc1C)c(=O)/c(=C/c1cccc(c1O)Br)/s3

STK529281
Synonyms: 8- methoxy- 3- ({(E)- [4- methoxy- 3- (piperidin- 1- ylmethyl)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1CN1CCCCC1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK529282
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 4- hydroxy- 1- methyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: O=C(c1c(O)c2ccccc2n(c1=O)C)NCc1ccc2c(c1)OCO2

STK529283
Synonyms: (5Z)- 1- (3- methoxyphenyl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)/C(=C/NN2CCCCC2c2cccnc2)/C1=O

STK529284
Synonyms: 2- (4- chlorophenyl)- N- (3- fluorophenyl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)c1nc(Nc2cccc(c2)F)c2c(n1)cccc2

STK529285
Synonyms: 3- {[(E)- (3- bromo- 2- hydroxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)Br

STK529286
Synonyms: 5- {[(2- bromoethyl)amino]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: BrCCNC=C1C(=O)NC(=O)NC1=O

STK529287
Synonyms: 2- (acetylamino)- 4,6- dinitrophenylfuran- 2- carboxylate
Smiles: CC(=O)Nc1cc(cc(c1OC(=O)c1ccco1)[N+](=O)[O-])[N+](=O)[O-]

STK529289
Synonyms: methyl5- methyl- 3- ({[4- (phenylcarbonyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccccc1)cc(cc2)C

STK529291
Synonyms: (5Z)- 1- (4- bromophenyl)- 5- [(prop- 2- en- 1- ylamino)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: C=CCN/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br

STK529292
Synonyms: 3- methyl- 7- octyl- 8- {(2E)- 2- [(3E)- 4- phenylbut- 3- en- 2- ylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(N/N=C(/C=C/c2ccccc2)\C)nc2c1c(=O)[nH]c(=O)n2C

STK529293
Synonyms: N- [2- (2- methoxyphenyl)ethyl]- 8- methyl- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1ccccc1CCNc1ncnc2c1[nH]c1c2cc(cc1)C

STK529294
Synonyms: 10- (5- bromo- 2- hydroxyphenyl)- 11- hydroxy- 6,7,8,10- tetrahydro- 9H- indeno[1,2- b]quinolin- 9- one
Smiles: Brc1ccc(c(c1)C1C2=C(CCCC2=O)N=C2C1=C(O)c1c2cccc1)O

STK529295
Synonyms: 2- (4- methoxyphenyl)- 1- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[1,2- a]benzimidazole
Smiles: COc1ccc(cc1)c1cn2c(n1CCN1CCCCC1)nc1c2cccc1

STK529297
Synonyms: 4- (4- methylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (pyridin- 3- ylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: Cc1cc[n+](cc1)c1[n-]c(=O)sc1/C=N/NC(=O)c1cccnc1

STK529298
Synonyms: 3- {[(E)- (3- iodophenyl)methylidene]amino}- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)I

STK529299
Synonyms: methyl5- methyl- 3- {[(4- phenylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cc(cc2)C

STK529300
Synonyms: methyl5- methyl- 3- {[(4- oxopiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=O)CC1)cc(cc2)C

STK529302
Synonyms: N- butyl- 2- [(2,2- diphenylcyclopropyl)carbonyl]hydrazinecarboxamide
Smiles: CCCCNC(=O)NNC(=O)C1C[C@@]1(c1ccccc1)c1ccccc1

STK529305
Synonyms: 8- (decylsulfanyl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCSc1nc2c(n1CCCCCCCCC)c(=O)[nH]c(=O)n2C

STK529306
Synonyms: methyl5- methoxy- 3- {[(2- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)OC

STK529307
Synonyms: N- {2- [(2,4- dichlorophenyl)(5- methylfuran- 2- yl)methyl]- 4,5- dimethoxyphenyl}- 4- methylbenzenesulfonamide
Smiles: COc1cc(c(cc1OC)NS(=O)(=O)c1ccc(cc1)C)C(c1ccc(cc1Cl)Cl)c1ccc(o1)C

STK529308
Synonyms: N'- [(3E)- 5- bromo- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- ({[(E)- (3,4- dimethoxyphenyl)methylidene]amino}oxy)acetohydrazide
Smiles: COc1cc(/C=N/OCC(=O)N/N=C/2\c3cc(Br)ccc3N(C2=O)CN2CCCCC2c2cccnc2)ccc1OC

STK529311
Synonyms: (2Z)- 2- cyano- 3- [(2- methoxy- 4- nitrophenyl)amino]prop- 2- enethioamide
Smiles: N#C/C(=C/Nc1ccc(cc1OC)[N+](=O)[O-])/C(=S)N

STK529313
Synonyms: 2- {1- oxo- 1- [(triethylstannanyl)oxy]propan- 2- yl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CC[Sn](OC(=O)C(N1C(=O)c2c(C1=O)cccc2)C)(CC)CC

STK529314
Synonyms: (2Z)- 3- (3,5- dibromo- 4- hydroxyphenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1cc(Br)c(c(c1)Br)O)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK529315
Synonyms: 8- [(2- aminoethyl)amino]- 7- hexadecyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(NCCN)nc2c1c(=O)[nH]c(=O)n2C

STK529316
Synonyms: 7- (3- ethoxy- 4- hydroxyphenyl)- 6H,7H,8H- pyrano[3,2- c:5,6- c']dichromene- 6,8- dione
Smiles: CCOc1cc(ccc1O)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3

STK529319
Synonyms: 1- ethyl- 4- hydroxy- 2- oxo- N- (4- oxo- 2- pentylquinazolin- 3(4H)- yl)- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)CC

STK529320
Synonyms: 2- [(2- methylphenyl)(phenyl)methylidene]- 1H- indene- 1,3(2H)- dione
Smiles: Cc1ccccc1/C(=C/1\C(=O)c2c(C1=O)cccc2)/c1ccccc1

STK529323
Synonyms: 6- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 4- (2- chlorophenyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)Br)nc(c(c1c1ccccc1Cl)C(=O)Nc1ccccc1C)C

STK529324
Synonyms: 8- methoxy- 3- {[(E)- (3- methoxyphenyl)methylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cccc(c1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK529326
Synonyms: (7Z)- 7- (5- bromo- 2- hydroxybenzylidene)- 3,4- diphenyl- 4H- [1,3]thiazolo[2,3- c][1,2,4]triazin- 6(7H)- one
Smiles: Brc1ccc(c(c1)/C=c/1\sc2=NN=C(C(n2c1=O)c1ccccc1)c1ccccc1)O

STK529327
Synonyms: 2- methyl- 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK529329
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)O

STK529330
Synonyms: N- (3,4- dichlorophenyl)- 2,5- dimethyl- 4- oxopiperidine- 1- carboxamide
Smiles: O=C1CC(C)N(CC1C)C(=O)Nc1ccc(c(c1)Cl)Cl

STK529332
Synonyms: ethyl3- ({[4- (9H- fluoren- 9- yl)piperazin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)cc(cc2)OC

STK529333
Synonyms: methyl3- ({[4- (9H- fluoren- 9- yl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)cc(cc2)C

STK529335
Synonyms: 8- (benzylamino)- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK529337
Synonyms: 2- (2- chlorophenyl)- 4- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK529338
Synonyms: 2- (3,4- dichlorophenyl)- 4- (2- methylphenoxy)quinazoline
Smiles: Cc1ccccc1Oc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK529342
Synonyms: 5- chloro- 3- (morpholin- 4- ylmethyl)- 1,3- benzoxazol- 2(3H)- one
Smiles: Clc1ccc2c(c1)n(CN1CCOCC1)c(=O)o2

STK529343
Synonyms: 2- phenyl- 4- {[(tributylstannanyl)oxy]carbonyl}quinoline
Smiles: CCCC[Sn](OC(=O)c1cc(nc2c1cccc2)c1ccccc1)(CCCC)CCCC

STK529345
Synonyms: 2,5- dimethyl- 1- (10H- phenothiazin- 10- ylcarbonyl)piperidin- 4- one
Smiles: O=C1CC(C)N(CC1C)C(=O)N1c2ccccc2Sc2c1cccc2

STK529346
Synonyms: 4- [2- amino- 3- cyano- 4,4- bis(trifluoromethyl)- 5,6,7,8- tetrahydroquinolin- 1(4H)- yl]- N- (6- methoxypyridazin- 3- yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2ccc(nn2)OC)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2

STK529347
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- N- (pyridin- 2- ylmethyl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccn2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK529349
Synonyms: N- {2- [1- (2,6- dimethylphenyl)- 1H- tetrazol- 5- yl]butan- 2- yl}- N- nitroso- 3- (trifluoromethyl)aniline
Smiles: O=NN(C(c1nnnn1c1c(C)cccc1C)(CC)C)c1cccc(c1)C(F)(F)F

STK529350
Synonyms: 4- [(E)- {2- [(2E)- 2- (2- hydroxybenzylidene)hydrazinyl]- 4- phenyl- 1,3- selenazol- 5- yl}diazenyl]benzenesulfonamide
Smiles: Oc1ccccc1/C=N/Nc1[se]c(c(n1)c1ccccc1)/N=N/c1ccc(cc1)S(=O)(=O)N

STK529351
Synonyms: 2- (thiophen- 2- yl)- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: O=C1NC(Nc2c1cccc2)c1cccs1

STK529352
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (2- methoxyphenyl)- 1,3- dioxo- 2,3- dihydro- 1H- benzo[de]isoquinoline- 6- carboxamide
Smiles: COc1cc(CCNC(=O)c2ccc3c4c2cccc4c(=O)n(c3=O)c2ccccc2OC)ccc1OC

STK529355
Synonyms: ethyl4- [(5E)- 5- (3,4- dimethoxybenzylidene)- 2,4,6- trioxotetrahydropyrimidin- 1(2H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)OC)OC)/C1=O

STK529358
Synonyms: 5- [(4- methoxyphenyl)amino]- 3- [(2- phenylethyl)amino]- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: COc1ccc(cc1)Nc1cc(NCCc2ccccc2)c2c3c1C(=O)c1ccccc1c3on2

STK529359
Synonyms: (2E,7E)- 2,7- bis(thiophen- 2- ylmethylidene)cycloheptanone
Smiles: O=C1/C(=C/c2cccs2)/CCCC/C/1=C\c1cccs1

STK529360
Synonyms: diphenyl{[(3- nitrophenyl)amino](phenyl)methyl}phosphonate
Smiles: [O-][N+](=O)c1cccc(c1)NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1

STK529362
Synonyms: 8- [(2- aminoethyl)amino]- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(NCCN)nc2c1c(=O)[nH]c(=O)n2C

STK529364
Synonyms: [2- (2- {[6- bromo- 2- (thiophen- 2- yl)quinolin- 4- yl]carbonyl}hydrazinylidene)- 7,7- dimethylbicyclo[2.2.1]hept- 1- yl]methanesulfonicacid
Smiles: Brc1ccc2c(c1)c(cc(n2)c1cccs1)C(=O)N/N=C/1\CC2C(C1(CC2)CS(=O)(=O)O)(C)C

STK529365
Synonyms: N- (2,4- dichlorophenyl)- 1- hexyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCn1c(=O)c(C(=O)Nc2ccc(cc2Cl)Cl)c(c2c1cccc2)O

STK529366
Synonyms: 3- (4- chlorophenyl)- 5- (4- nitrophenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK529368
Synonyms: ethyl3- {[(4- carbamoylpiperidin- 1- yl)acetyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C(=O)N)cc(cc2)OC

STK529371
Synonyms: 7- (3- bromobenzyl)- 3- methyl- 8- {(2E)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Brc1cccc(c1)Cn1c(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc2c1c(=O)[nH]c(=O)n2C

STK529372
Synonyms: N'- [(4- aminophenyl)sulfonyl]- 4- hydroxy- 2- oxo- 1- propyl- 1,2- dihydroquinoline- 3- carbohydrazide
Smiles: CCCn1c(=O)c(C(=O)NNS(=O)(=O)c2ccc(cc2)N)c(c2c1cccc2)O

STK529373
Synonyms: 2- hydroxy- 5- [(4- nitro- 2,1,3- benzoxadiazol- 5- yl)amino]benzoicacid
Smiles: OC(=O)c1cc(ccc1O)Nc1ccc2c(c1[N+](=O)[O-])non2

STK529375
Synonyms: 3- [4- (pyridin- 4- yl)pyridinium- 1- yl]propane- 1- sulfonate
Smiles: [O-]S(=O)(=O)CCC[n+]1ccc(cc1)c1ccncc1

STK529376
Synonyms: 7- hexadecyl- 3- methyl- 8- [(2- oxopropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)C)nc2c1c(=O)[nH]c(=O)n2C

STK529379
Synonyms: 5- bromobenzo[1,2- c:3,4- c']bis[1,2,5]oxadiazole1- oxide
Smiles: Brc1cc2no[n+](c2c2c1non2)[O-]

STK529380
Synonyms: 1- (5- methoxy- 1H- indol- 3- yl)- 2- (morpholin- 4- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCOCC1

STK529381
Synonyms: 3,7- dimethyl- 8- [(2- methylpropyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CSc1nc2c(n1C)c(=O)[nH]c(=O)n2C)C

STK529385
Synonyms: N'- [(3E)- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 4- carbohydrazide
Smiles: O=C1N(CN2CCCCC2c2cccnc2)c2c(/C/1=N\NC(=O)c1ccncc1)cccc2

STK529386
Synonyms: N- (1- {(2E)- 2- [4- methoxy- 3- (morpholin- 4- ylmethyl)benzylidene]hydrazinyl}- 1- oxopropan- 2- yl)benzamide(non- preferredname)
Smiles: COc1ccc(cc1CN1CCOCC1)/C=N/NC(=O)C(NC(=O)c1ccccc1)C

STK529387
Synonyms: 4- nitro- N'- [(1E)- 1- (3- oxo- 3H- benzo[f]chromen- 2- yl)ethylidene]benzohydrazide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])N/N=C(/c1cc2c(oc1=O)ccc1c2cccc1)\C

STK529389
Synonyms: 3- [2- (dimethylamino)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CN(CCn1cnc2c(c1=O)[nH]c1c2cccc1)C

STK529391
Synonyms: (5Z)- 1,3,5- triphenyl- 5- (2- phenylhydrazinylidene)pentan- 1- one
Smiles: O=C(c1ccccc1)CC(c1ccccc1)C/C(=N/Nc1ccccc1)/c1ccccc1

STK529392
Synonyms: 6- methoxy- 3- {4- [4- (phenylsulfanyl)phenyl]- 1,3- thiazol- 2- yl}- 2H- chromen- 2- one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc(cc1)Sc1ccccc1

STK529393
Synonyms: 4- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc2ccccc2n2c1nnc2

STK529394
Synonyms: methyl3- {[(4- phenylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cccc2

STK529395
Synonyms: 7- hexadecyl- 8- hydrazinyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCCCCCCCCn1c(NN)nc2c1c(=O)[nH]c(=O)n2C

STK529396
Synonyms: 5- [(4- chlorophenyl)amino]- 3- (methylamino)- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: CNc1cc(Nc2ccc(cc2)Cl)c2c3c1noc3c1c(C2=O)cccc1

STK529398
Synonyms: 2- [{[dimethyl(oxido)- lambda~6~- sulfanylidene]amino}(diphenyl)- lambda~5~- phosphanylidene]- 1- (4- nitrophenyl)- 2- [(E)- phenyldiazenyl]ethanone
Smiles: O=C(C(=P(c1ccccc1)(c1ccccc1)N=S(=O)(C)C)/N=N/c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK529400
Synonyms: 3- {[(1E,2E)- 3- (1,3- benzodioxol- 5- yl)- 2- methylprop- 2- en- 1- ylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/C(=C/c1ccc2c(c1)OCO2)/C

STK529402
Synonyms: 4- (3- methylpyridinium- 1- yl)- 2- oxo- 5- {(E)- [2- (pyridin- 4- ylcarbonyl)hydrazinylidene]methyl}- 1,3- thiazol- 3- ide
Smiles: Cc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccncc1

STK529403
Synonyms: 3- [2- (4- fluorophenyl)ethyl]- 8- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK529405
Synonyms: N- {2- [(2,4- dichlorophenyl)(hydroxy)methyl]- 4,5- dimethoxyphenyl}- 4- methylbenzenesulfonamide
Smiles: COc1cc(c(cc1OC)NS(=O)(=O)c1ccc(cc1)C)C(c1ccc(cc1Cl)Cl)O

STK529407
Synonyms: 1,1- bis(diethylamino)- N'- (4- nitrophenyl)phosphanecarbohydrazonamideoxide
Smiles: CCN(P(=O)(/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/N)N(CC)CC)CC

STK529409
Synonyms: diphenyl(5,7,8,9- tetrahydro- 6H- dibenzo[c,h]xanthen- 7- yl)phosphaneoxide
Smiles: O=P(C1C2=C(OC3=C1CCc1c3cccc1)c1c(CC2)cccc1)(c1ccccc1)c1ccccc1

STK529410
Synonyms: 1- (1,1,1,3,3,3- hexafluoro- 2- phenoxypropan- 2- yl)- 3- (3- methyl- 1- phenyl- 1H- pyrazol- 5- yl)urea
Smiles: Cc1cc(n(n1)c1ccccc1)NC(=O)NC(C(F)(F)F)(C(F)(F)F)Oc1ccccc1

STK529411
Synonyms: 3- chloro- N- [(1Z)- 4,4,6- trimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]aniline
Smiles: Clc1cccc(c1)/N=c/1\ssc2c1c1cccc(c1NC2(C)C)C

STK529412
Synonyms: (2E)- 3- [(2- methyl- 4- nitrophenyl)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)[N+](=O)[O-])/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK529415
Synonyms: methyl5- chloro- 3- ({[4- (2- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cc(cc2)Cl

STK529417
Synonyms: 2- (2,4- dichlorophenyl)- 4- {(2E)- 2- [1- (4- methylphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Cc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)/C

STK529418
Synonyms: N- [3- (2,2- diphenylhydrazinyl)- 3- oxopropyl]- 2- {[(4- methoxyphenyl)carbonyl]amino}benzamide(non- preferredname)
Smiles: COc1ccc(cc1)C(=O)Nc1ccccc1C(=O)NCCC(=O)NN(c1ccccc1)c1ccccc1

STK529419
Synonyms: Nalpha- (cyclohexylcarbamoyl)- N- (4- methoxyphenyl)tryptophanamide
Smiles: COc1ccc(cc1)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)NC1CCCCC1

STK529423
Synonyms: (3E)- 3- [(3- methoxyphenyl)imino]- 2- (4- nitrophenyl)- 2,3- dihydro- 1H- inden- 1- one
Smiles: COc1cccc(c1)/N=C/1\C(c2ccc(cc2)[N+](=O)[O-])C(=O)c2c1cccc2

STK529424
Synonyms: methyl(2E)- 2- (4- chlorobenzylidene)- 5- (4- fluorophenyl)- 7- methyl- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)c(=O)/c(=C\c1ccc(cc1)Cl)/s2

STK529425
Synonyms: 4- (4- methylphenyl)- 4- oxobutane- 1,1,2,2- tetracarbonitrile
Smiles: N#CC(C(C#N)C#N)(CC(=O)c1ccc(cc1)C)C#N

STK529427
Synonyms: methyl5- bromo- 3- ({[4- (7- ethyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)cc(cc2)Br

STK529428
Synonyms: N- (4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 3- yl)acetamide
Smiles: CC(=O)Nn1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK529429
Synonyms: [3- amino- 6- cyclopropyl- 4- (2- fluorophenyl)thieno[2,3- b]pyridin- 2- yl](4- bromophenyl)methanone
Smiles: Brc1ccc(cc1)C(=O)c1sc2c(c1N)c(cc(n2)C1CC1)c1ccccc1F

STK529431
Synonyms: ethyl3- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC