COMPOUNDS FOR BIOLOGICAL SCREENING
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STK548979
Synonyms: (5Z)- 3- (2- bromophenyl)- 5- [4- (octyloxy)benzylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK548981
Synonyms: 1- (4- bromophenyl)- 2- (4- chlorophenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: Clc1ccc(cc1)c1nc2c(n1c1ccc(cc1)Br)nc1c(n2)cccc1

STK548982
Synonyms: (2Z)- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl][2- (4- fluorophenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)F)/c1scc(n1)c1ccc2c(c1)OCO2

STK548983
Synonyms: 2- {4- [(2- methoxyethyl)amino]quinazolin- 2- yl}phenol
Smiles: COCCNc1nc(nc2c1cccc2)c1ccccc1O

STK548984
Synonyms: 4- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 2- (2- fluorophenyl)quinazoline
Smiles: Clc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1F

STK548985
Synonyms: N- (2- chlorophenyl)- 7- (3- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCCN(C1)c1cc(Nc2ccccc2Cl)c(c2c1non2)[N+](=O)[O-]

STK548987
Synonyms: 2- (4- nitrophenyl)- 2- oxoethyl(diethoxyphosphoryl)acetate
Smiles: CCOP(=O)(CC(=O)OCC(=O)c1ccc(cc1)[N+](=O)[O-])OCC

STK548988
Synonyms: 2- ethyl- 8,8- dimethyl- 4- (2- methylpropoxy)- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCc1nc(OCC(C)C)c2c(n1)c1cc3COC(Cc3nc1s2)(C)C

STK548989
Synonyms: 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK548991
Synonyms: N- (4- acetylphenyl)- 2- {[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]sulfanyl}acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3SCC(=O)Nc1ccc(cc1)C(=O)C)C

STK548993
Synonyms: N- (4- iodophenyl)- 7- (3- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCCN(C1)c1cc(Nc2ccc(cc2)I)c(c2c1non2)[N+](=O)[O-]

STK548994
Synonyms: 11- (4- tert- butylphenyl)- N- (3- chloro- 4- methylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccc(cc1)C(C)(C)C)n1c(=N2)c(Nc2ccc(c(c2)Cl)C)nc2c1cccc2)c1ccccc1

STK548995
Synonyms: (8R,8aS,11aR)- N- (4- chlorophenyl)- 10- (4- methoxyphenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 8- carboxamide
Smiles: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1N([C@H]2C(=O)Nc2ccc(cc2)Cl)N=Cc2c1cccc2

STK548997
Synonyms: 3- (4- ethylphenyl)- 5,5a,6,7,8,9- hexahydro- 4H- 1,2- benzodiazepine
Smiles: CCc1ccc(cc1)C1=NN=C2C(CC1)CCCC2

STK548998
Synonyms: N- (4- methylphenyl)- 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: CSc1nc(SCC(=O)Nc2ccc(cc2)C)c2c(n1)sc1c2CCCC1

STK548999
Synonyms: 2- (hexylsulfanyl)- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCC3

STK549001
Synonyms: 2- {[2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK549002
Synonyms: N- (4- bromophenyl)- 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549003
Synonyms: 2- [(Z)- benzylidene(oxido)- lambda~5~- azanyl]- 1- (furan- 2- yl)propan- 1- one
Smiles: [O-]/[N+](=C\c1ccccc1)/C(C(=O)c1ccco1)C

STK549005
Synonyms: 2- chloro- N'- [6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CSc1nc(NNC(=O)c2ccccc2Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK549006
Synonyms: 5- (4- methoxyphenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK549007
Synonyms: 2- {(2Z)- 2- [3,5- bis(4- methylphenyl)cyclohex- 2- en- 1- ylidene]hydrazinyl}- 6- methyl- 4- phenylquinazoline
Smiles: Cc1ccc(cc1)C1C/C(=N/Nc2nc3ccc(cc3c(n2)c2ccccc2)C)/C=C(C1)c1ccc(cc1)C

STK549010
Synonyms: 1- phenyl- 1H- tetrazol- 5- yl(1E)- N- (3- chlorophenyl)- 2- oxopropanehydrazonothioate
Smiles: Clc1cccc(c1)N/N=C(\C(=O)C)/Sc1nnnn1c1ccccc1

STK549011
Synonyms: 2- (2,3- dimethylphenoxy)- N'- [(3Z)- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]acetohydrazide
Smiles: O=C(COc1cccc(c1C)C)N/N=C/1\C(=O)N(c2c1cccc2)CN1CCCCC1c1cccnc1

STK549012
Synonyms: ethyl3- {[3- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)propanoyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC3(CC1)OCCO3)cc(cc2)OC

STK549013
Synonyms: 3- [(2- chlorobenzyl)sulfanyl]- 10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccccc1Cl)nn2)CC(OC3)(C)C

STK549014
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (1,3- benzodioxol- 5- yl)ethylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)/c1ccc2c(c1)OCO2

STK549015
Synonyms: 3- [5- (4- chloro- 3- ethylphenoxy)pentyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: CCc1cc(OCCCCCn2c(nc3c(c2=O)cccc3)c2ccc(cc2)Cl)ccc1Cl

STK549017
Synonyms: 5- (2- methoxyphenyl)- 2- phenyl- 3- propyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCCC1N(OC2C1C(=O)N(C2=O)c1ccccc1OC)c1ccccc1

STK549019
Synonyms: 3- (3- chlorophenyl)- 1- (2,4- dichlorobenzyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c2sc3c(c2c(=O)n(c1=O)c1cccc(c1)Cl)CCCC3

STK549020
Synonyms: 2- chloro- 10- [3- chloro- 2,5- difluoro- 6- (morpholin- 4- yl)pyridin- 4- yl]- 10H- phenothiazine
Smiles: Clc1ccc2c(c1)N(c1c(F)c(nc(c1Cl)F)N1CCOCC1)c1c(S2)cccc1

STK549021
Synonyms: 3- (2- methylpropyl)- 2- (methylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK549022
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(Z)- (2- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C\c1ccccc1F

STK549023
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cc(OC)cc2

STK549024
Synonyms: (5Z)- 5- ({1- [3- (2,3- dimethylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2cccc(c2C)C)/C1=O

STK549025
Synonyms: ethyl7- {[(2,6- dimethylmorpholin- 4- yl)acetyl]amino}- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CC(C)OC(C1)C)cc1c(c2)OCO1

STK549026
Synonyms: 2- {4- [(3- chlorophenyl)amino]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Nc2cccc(c2)Cl)c2c(n1)cccc2

STK549028
Synonyms: [5- (4- bromophenyl)- 3- (6- chloro- 2- methyl- 4- phenylquinolin- 3- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](2- chlorophenyl)methanone
Smiles: Brc1ccc(cc1)C1CC(=NN1C(=O)c1ccccc1Cl)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Cl

STK549029
Synonyms: ethyl4- (8- chloro- 2,4- dioxo- 3,4- dihydropyrimido[4,5- b]quinolin- 10(2H)- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c2cc(Cl)ccc2cc2c1nc(=O)[nH]c2=O

STK549030
Synonyms: 2- {5- [(Z)- (1- hexyl- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]- 2- methoxybenzyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CCCCCCN1C(=S)NC(=O)/C(=C/c2ccc(c(c2)CN2C(=O)c3c(C2=O)cccc3)OC)/C1=O

STK549031
Synonyms: N- cyclohexyl- 2- imino- 1- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1)NC1CCCCC1

STK549032
Synonyms: 2- (hexylsulfanyl)- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK549033
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)Br)nn2)CC(OC3)(C)C

STK549034
Synonyms: N- {1- (4- butylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- chlorobenzenesulfonamide
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C

STK549036
Synonyms: 3,7- bis[(2,4- dichlorophenyl)carbonyl]- 1,5- diethyl- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: CCC12CN(CC(C2=O)(CN(C1)C(=O)c1ccc(cc1Cl)Cl)CC)C(=O)c1ccc(cc1Cl)Cl

STK549037
Synonyms: 2- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (3- nitrophenyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 4- bromophenylbenzoate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)OC(=O)c1ccccc1

STK549038
Synonyms: 5- [3- (benzyloxy)- 4- methoxyphenyl]- 2- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1OCc1ccccc1)C1Oc2ccccc2C2N1N=C(C2)c1ccccc1

STK549039
Synonyms: N- (diphenylmethyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK549040
Synonyms: (5Z)- 5- ({1- [2- (4- bromophenoxy)ethyl]- 1H- pyrrol- 2- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cccn2CCOc2ccc(cc2)Br)/C1=O

STK549041
Synonyms: 4- (4- chloro- 3,5- dimethylphenoxy)- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccccc1c1nc(Oc2cc(C)c(c(c2)C)Cl)c2c(n1)cccc2

STK549042
Synonyms: 2- ({5- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2sc3c(c2C#N)CCCC3)nnc1CSc1nc2c(s1)cccc2

STK549044
Synonyms: 3- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: O=c1n(cnc2c1C1(CCCCC1)Cc1c2cccc1)C1CCOC(C1)(C)C

STK549046
Synonyms: ethyl1- acetyl- 7- (4- iodophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)I)C(=O)C

STK549048
Synonyms: 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: O=C(N1CCCCC1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK549049
Synonyms: 2- [(5- ethyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- N- phenylacetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccccc1)nn2)CCC3

STK549050
Synonyms: 4- (2- chlorophenyl)- 5- [(1R,2R)- 2- phenylcyclopropyl]- 4H- 1,2,4- triazole- 3- thiol
Smiles: Clc1ccccc1n1c(S)nnc1[C@@H]1C[C@H]1c1ccccc1

STK549051
Synonyms: 2- (benzylsulfanyl)- 3- (3- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1cccc(c1)n1c(SCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549052
Synonyms: 4- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(N/N=C/c2ccc(cc2)[N+](=O)[O-])c2c(n1)cccc2)C

STK549055
Synonyms: 11- pentyl- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK549056
Synonyms: 4- [(2E)- 2- (2- fluorobenzylidene)hydrazinyl]- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(N/N=C/c2ccccc2F)c2c(n1)cccc2)C

STK549057
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[2,5- dimethyl- 1- (naphthalen- 2- yl)- 1H- pyrrol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc(n(c2C)c2ccc3c(c2)cccc3)C)/C1=O)C

STK549058
Synonyms: 3- (2,6- dichlorophenyl)- 2- {(E)- 2- [4- (propan- 2- yl)phenyl]ethenyl}quinazolin- 4(3H)- one
Smiles: CC(c1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1c(Cl)cccc1Cl)C

STK549059
Synonyms: 3- [6- (2- bromo- 4- methylphenoxy)hexyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccc(cc1Br)C

STK549061
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (naphthalen- 2- yl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1c1cccnc1

STK549062
Synonyms: 1- [(2- chlorobenzyl)sulfanyl]- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCc3ccccc3Cl)nnc2n(c1=O)c1cccc(c1)C)C

STK549063
Synonyms: propan- 2- yl2- amino- 1- (4- butylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK549064
Synonyms: N- benzyl- 3- (4- methylphenyl)- 3- [4- (propan- 2- yloxy)phenyl]propanamide
Smiles: Cc1ccc(cc1)C(c1ccc(cc1)OC(C)C)CC(=O)NCc1ccccc1

STK549066
Synonyms: ethyl4- [5- (morpholin- 4- yl)- 8- oxo- 1,3,4,8- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 9(2H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK549068
Synonyms: 2,2'- {[12- (propan- 2- yl)- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine- 3,7- diyl]disulfanediyl}bis[1- (4- chlorophenyl)ethanone]
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)c2ccc(cc2)Cl)nn1)CC(OC3)C(C)C

STK549069
Synonyms: 3- (furan- 2- ylmethyl)- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549072
Synonyms: N- (4- methylphenyl)- 4- [4- (morpholin- 4- yl)- 3- nitrophenyl]phthalazin- 1- amine
Smiles: Cc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

STK549073
Synonyms: 2- [(2,6- dichlorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCc2c(Cl)cccc2Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK549074
Synonyms: ethyl3- {[3- (4- carbamoylpiperidin- 1- yl)propanoyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)C(=O)N)cc(cc2)OC

STK549075
Synonyms: (2E)- N- (2- {(2E)- 2- [(2- methyl- 1H- indol- 3- yl)methylidene]hydrazinyl}- 2- oxoethyl)- 3- phenylprop- 2- enamide(non- preferredname)
Smiles: O=C(CNC(=O)/C=C/c1ccccc1)N/N=C/c1c(C)[nH]c2c1cccc2

STK549076
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK549079
Synonyms: (1'S,2'S,3R,3a'R)- 1'- (2,2- dimethylpropanoyl)- 2'- [(3- methoxyphenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK549080
Synonyms: 2- amino- N- (3- methylphenyl)- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1cccc(c1)C

STK549081
Synonyms: N- (4- acetylphenyl)- 2- {[5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)C(=O)C)nn2)CCCC3

STK549083
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- (2- methylprop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CC(=C)Cn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549084
Synonyms: 2,2'- {[12- (propan- 2- yl)- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine- 3,7- diyl]disulfanediyl}bis(1- phenylethanone)
Smiles: CC(C1OCc2c(C1)c1c3nnc(n3c3n(c1s2)c(SCC(=O)c1ccccc1)nn3)SCC(=O)c1ccccc1)C

STK549085
Synonyms: 3- [4- (dimethylamino)phenyl]- 5- (2- methoxyphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)N(C)C)c1ccccc1

STK549088
Synonyms: 1- (4- bromophenyl)- 5- (2- methoxyphenyl)- 3- (phenylcarbonyl)- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)C(=NN2c1ccc(cc1)Br)C(=O)c1ccccc1

STK549089
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [5- (4- nitrophenyl)furan- 2- yl]methylidene}- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1COc1ccccc1)c1nonc1N)N/N=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]

STK549090
Synonyms: N- (4- methoxyphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCC3

STK549091
Synonyms: N- (2- chlorophenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccccc2Cl)c2c(n1)cccc2)C

STK549092
Synonyms: (5Z)- 1- (2- ethylphenyl)- 5- (2,4,5- trimethoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cc(OC)c(cc1/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1CC)OC

STK549093
Synonyms: 2- (4- butoxyphenyl)- 4- [(2,6- dichlorobenzyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2c(Cl)cccc2Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK549096
Synonyms: N'- [11- (3- bromophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]- N,N- diethylbenzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Br)c(nn1c1ccccc1)C)CC

STK549097
Synonyms: N- (3- chloro- 4- fluorophenyl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)F)c1ccccc1

STK549098
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: Fc1cccc(c1)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK549099
Synonyms: N- [(2- {[5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]carbonyl}hydrazinyl)carbonothioyl]- 5- methyl- 3- phenyl- 1,2- oxazole- 4- carboxamide
Smiles: S=C(NC(=O)c1c(C)onc1c1ccccc1)NNC(=O)c1n[nH]c(c1)c1ccc(cc1)F

STK549100
Synonyms: 2- {[8,8- dimethyl- 11- (morpholin- 4- yl)- 7,10- dihydro- 8H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK549102
Synonyms: 5- (2- chlorophenyl)- 3- [(naphthalen- 2- ylmethyl)sulfanyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccccc1c1nc2sc3c(c2c2n1c(SCc1ccc4c(c1)cccc4)nn2)CCCC3

STK549103
Synonyms: 2- (4- fluorophenyl)- 3- oxo- 1- (prop- 2- en- 1- yl)- 2,3- dihydro- 1H- isoindole- 4- carboxylicacid
Smiles: C=CCC1N(c2ccc(cc2)F)C(=O)c2c1cccc2C(=O)O

STK549104
Synonyms: 3- (4- methoxyphenyl)- 2- [(2- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549105
Synonyms: N- benzyl- 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549106
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549107
Synonyms: ethyl4- [2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- oxoethyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cc(OC)cc2

STK549108
Synonyms: N- (diphenylmethyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549109
Synonyms: 4- [4- methyl- 3- (morpholin- 4- ylsulfonyl)phenyl]- 2- [2- oxo- 2- (4- phenylpiperazin- 1- yl)ethyl]phthalazin- 1(2H)- one
Smiles: O=C(N1CCN(CC1)c1ccccc1)Cn1nc(c2ccc(c(c2)S(=O)(=O)N2CCOCC2)C)c2c(c1=O)cccc2

STK549110
Synonyms: 6- chloro- 2- [5- (3,4- dimethoxyphenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- phenylquinazoline
Smiles: COc1cc(ccc1OC)C1CC(=NN1c1nc2ccc(cc2c(n1)c1ccccc1)Cl)c1cccs1

STK549111
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK549112
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [2- (2- methoxyphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK549116
Synonyms: 11- (3- bromophenyl)- N- (3- chloro- 4- methylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK549117
Synonyms: 2- [(Z)- (1- benzyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 3- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)n1c(/C=C\2/c3ccccc3N(C2=O)Cc2ccccc2)nc2c(c1=O)cccc2

STK549118
Synonyms: 6,6- dimethyl- 2- (methylsulfanyl)- 4- (propan- 2- ylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CSc1nc(SC(C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK549121
Synonyms: 4- {(2Z)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 2- (2- fluorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C(=N\Nc1nc(nc2c1cccc2)c1ccccc1F)/C

STK549122
Synonyms: 1- ethyl- 6- fluoro- 4- oxo- 7- (4- {[(3,4,5- trimethoxyphenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK549123
Synonyms: ethyl1- acetyl- 7- (3- nitrophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])C(=O)C

STK549124
Synonyms: (6aS,6bR,9aS,10R)- 8- (2,4- dichlorophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Clc1ccc(c(c1)Cl)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK549125
Synonyms: 7,7- dimethyl- 1- (2- methylpropyl)- 2- phenyl- 1,5,7,8- tetrahydro- 4H- pyrano[4,3- d]pyrimidine- 4- thione
Smiles: CC(Cn1c(nc(=S)c2c1CC(C)(C)OC2)c1ccccc1)C

STK549126
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [2- (2,6- dimethylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCOc1c(C)cccc1C)c1ccc(c(c1)Cl)C

STK549127
Synonyms: 5- (3- methylphenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Cc1cccc(c1)N1C(=O)C2C(C1=O)ON(C2c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK549128
Synonyms: N- (2,5- dimethoxyphenyl)- 2,2- diphenylcyclopropanecarboxamide
Smiles: COc1ccc(c(c1)NC(=O)C1CC1(c1ccccc1)c1ccccc1)OC

STK549131
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3

STK549132
Synonyms: 2- methoxy- 4- [10- methyl- 8- phenyl- 6- (phenylamino)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl]phenol
Smiles: COc1cc(ccc1O)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccccc1)c1ccccc1

STK549133
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (3- methylphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCc1ccc(cc1)Cl)C

STK549134
Synonyms: 2- (pyridin- 4- yl)- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclopentane]
Smiles: n1ccc(cc1)c1nc2n(n1)cnc1c2C2(CCCC2)Cc2c1cccc2

STK549135
Synonyms: 1- (5- tert- butyl- 4- methyl- 1,3- thiazol- 2- yl)- 3- prop- 2- en- 1- ylthiourea
Smiles: C=CCNC(=S)Nc1nc(c(s1)C(C)(C)C)C

STK549136
Synonyms: 2- (5- {(Z)- [1- (4- bromophenyl)- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}- 2- methoxybenzyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)Br

STK549137
Synonyms: 8- fluoro- 3- {[(E)- (3- fluorophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)F

STK549138
Synonyms: 2- [(5- oxo- 4- phenyl- 4,5,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC3)NCCc1ccccc1

STK549139
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(1Z)- 1- (2,4- dichlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C(\c1ccc(cc1Cl)Cl)/C

STK549140
Synonyms: 2- [(E)- 2- (4- fluorophenyl)ethenyl]- 6- iodo- 3- (naphthalen- 1- yl)quinazolin- 4(3H)- one
Smiles: Fc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1cccc2c1cccc2)I

STK549142
Synonyms: ethyl5,6- dimethoxy- 3- [(2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}propanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)C)cc(c(c2)OC)OC

STK549143
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[1- (3- phenoxypropyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccccc2)/C1=O)C

STK549144
Synonyms: 3- (2- methylpropyl)- 2- (pentylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK549145
Synonyms: 2- (1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)- N'- [(E)- (3- methylthiophen- 2- yl)methylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1sccc1C

STK549146
Synonyms: N- benzyl- 5- nitro- 2- (piperidin- 1- yl)pyrimidine- 4,6- diamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)nc(nc1N)N1CCCCC1

STK549147
Synonyms: 2- (methoxycarbonyl)phenyl4- (2,4- dichlorophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1Cl)Cl

STK549148
Synonyms: (4- bromophenyl)[5- (2- chloro- 7- methylquinolin- 3- yl)- 3- (4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cc2ccc(cc2nc1Cl)C)C(=O)c1ccc(cc1)Br

STK549149
Synonyms: (5E)- 5- [4- (dimethylamino)- 3- nitrobenzylidene]- 1- (2,5- dimethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)[N+](=O)[O-])N(C)C)/C1=O)C

STK549152
Synonyms: 7- [2- (biphenyl- 4- yl)- 2- oxo- 1- phenylethyl]- 8- bromo- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(C(n1c(Br)nc2c1c(=O)n(C)c(=O)n2C)c1ccccc1)c1ccc(cc1)c1ccccc1

STK549153
Synonyms: ethyl5,6- dimethoxy- 3- {[3- (4- methylpiperidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)C)cc(c(c2)OC)OC

STK549154
Synonyms: 6,6- dimethyl- 3- phenyl- 2- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: O=c1c2c(sc3c2CC(C)(C)OC3)nc(n1c1ccccc1)SC/C=C/c1ccccc1

STK549155
Synonyms: N- {[2- (pyridin- 3- yl)piperidin- 1- yl]carbamothioyl}- 9H- xanthene- 9- carboxamide
Smiles: S=C(NC(=O)C1c2ccccc2Oc2c1cccc2)NN1CCCCC1c1cccnc1

STK549157
Synonyms: 4- {(E)- [(2E)- 2- {1- cyano- 2- [(3,4- dichlorophenyl)amino]- 2- oxoethylidene}- 4- oxo- 3- phenyl- 1,3- thiazolidin- 5- ylidene]methyl}phenyl4- bromobenzoate
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(cc2)OC(=O)c2ccc(cc2)Br)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(c(c1)Cl)Cl

STK549158
Synonyms: 2- amino- 1- (2- methoxyphenyl)- N- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCC1CCCO1

STK549159
Synonyms: (4aR,4bS,7aR,8S)- 6- (2- methyl- 5- nitrophenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C([C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])c1ccccc1

STK549160
Synonyms: 3- phenyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: O=c1n(cnc2c1C1(CCCCC1)Cc1c2cccc1)c1ccccc1

STK549164
Synonyms: methyl1- acetyl- 7- (3- nitrophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])C(=O)C

STK549165
Synonyms: 3- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}- 8- nitro- 2H- chromen- 2- one
Smiles: CC(Cc1ccc(cc1)c1csc(n1)c1cc2cccc(c2oc1=O)[N+](=O)[O-])C

STK549167
Synonyms: 1- acetyl- 3- (biphenyl- 4- yl)- 7,9- dimethyl- 4- phenyl- 1,4- dihydro[1,2,4]triazino[3,4- f]purine- 6,8(7H,9H)- dione
Smiles: CC(=O)N1N=C(c2ccc(cc2)c2ccccc2)C(n2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1

STK549169
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- [3- (trifluoromethyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F)C

STK549171
Synonyms: (5Z)- 3- [4- (diethylamino)phenyl]- 5- (2- methoxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCN(c1ccc(cc1)N1C(=S)S/C(=C\c2ccccc2OC)/C1=O)CC

STK549172
Synonyms: 1- (2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)- 3- prop- 2- en- 1- ylthiourea
Smiles: C=CCNC(=S)Nc1c[nH]c(=O)[nH]c1=O

STK549174
Synonyms: 11- (3- methoxypropyl)- 3- (tetrahydrofuran- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCCn1c2nc3ccccc3nc2c2c1ncn(c2=O)CC1CCCO1

STK549175
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549176
Synonyms: ethyl1- acetyl- 7- (3- methylphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)C)C(=O)C

STK549178
Synonyms: 1- (4- bromophenyl)- 2- [(5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]ethanone
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Br)nn2)CC(OC3)(C)C

STK549180
Synonyms: (5Z)- 5- ({1- [2- (4- bromophenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Brc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1

STK549181
Synonyms: (5Z)- 5- ({1- [3- (4- chlorophenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccc(cc2)Cl)/C1=O

STK549183
Synonyms: ethyl4- {6- iodo- 2- [(E)- 2- (3- methylphenyl)ethenyl]- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2cccc(c2)C)nc2c(c1=O)cc(cc2)I

STK549184
Synonyms: 11- (4- chloro- 3- nitrophenyl)- 3- hexyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)[N+](=O)[O-])Cl

STK549185
Synonyms: 1- chloro- 6- fluoro- 4- (4- fluorophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline
Smiles: ClC1C(CC2C1c1cccc(c1NC2c1ccc(cc1)F)F)Sc1ccccc1[N+](=O)[O-]

STK549186
Synonyms: [4- amino- 2- (prop- 2- en- 1- ylamino)- 1,3- thiazol- 5- yl](tricyclo[3.3.1.1~3,7~]dec- 1- yl)methanone
Smiles: C=CCNc1nc(c(s1)C(=O)C12CC3CC(C2)CC(C1)C3)N

STK549188
Synonyms: N,N- diethyl- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)CC

STK549189
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2- methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549191
Synonyms: N- {3- [bis(2- methylpropyl)amino]- 2- hydroxypropyl}- N- (4- methylphenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1)C)CN(CC(C)C)CC(C)C

STK549193
Synonyms: 2- {4- [(3- fluorophenyl)amino]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Nc2cccc(c2)F)c2c(n1)cccc2

STK549194
Synonyms: 1- [5- (4- fluorophenyl)- 1,3,4- thiadiazol- 2- yl]- 3- (2- methylphenyl)urea
Smiles: O=C(Nc1ccccc1C)Nc1nnc(s1)c1ccc(cc1)F

STK549196
Synonyms: 11- (4- tert- butylphenyl)- N- (3,4- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccc(cc1)C(C)(C)C)n1c(=N2)c(Nc2ccc(c(c2)C)C)nc2c1cccc2)c1ccccc1

STK549197
Synonyms: 4- (benzyloxy)- N- [(5Z)- 5- (4- ethoxy- 3- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1

STK549201
Synonyms: (5E)- 1- cyclohexyl- 5- ({[2- (piperazin- 1- yl)ethyl]amino}methylidene)- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/NCCN1CCNCC1)C1CCCCC1

STK549202
Synonyms: 1- [(2,4- dichlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n2c1nnc2SCc1ccc(cc1Cl)Cl

STK549203
Synonyms: (2'R,3'R)- 2'- (furan- 2- yl)- 3'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccco1)C(=O)c1c(C2=O)cccc1)cccc3

STK549205
Synonyms: 6- chloro- 3- {5- (4- chlorophenyl)- 1- [(2- chlorophenyl)carbonyl]- 4,5- dihydro- 1H- pyrazol- 3- yl}- 4- phenylquinolin- 2(1H)- one
Smiles: Clc1ccc(cc1)C1CC(=NN1C(=O)c1ccccc1Cl)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK549206
Synonyms: 2- [(E)- 2- (4- bromophenyl)ethenyl]- 6- iodo- 3- (2- methyl- 5- nitrophenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1cc(ccc1C)[N+](=O)[O-])I

STK549207
Synonyms: N,N- dibutyl- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3)CCCC

STK549209
Synonyms: 3- ethyl- 6- hydroxy- 2- (octylsulfanyl)- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)pyrimidin- 4(3H)- one
Smiles: CCCCCCCCSc1nc(O)c(c(=O)n1CC)C1NCCc2c1cccc2

STK549210
Synonyms: 2- (1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)- N'- [(1E)- 1- (4- methoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)/C

STK549211
Synonyms: 1,4- bis(2,4- dinitronaphthalen- 1- yl)piperazine
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1N1CCN(CC1)c1c(cc(c3c1cccc3)[N+](=O)[O-])[N+](=O)[O-])cccc2

STK549213
Synonyms: 2- amino- 1- (1,3- benzodioxol- 5- yl)- N- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1cc(CCNC(=O)c2c(N)n(c3c2nc2ccccc2n3)c2ccc3c(c2)OCO3)ccc1OC

STK549214
Synonyms: (5E)- 1- (2,4- dimethylphenyl)- 5- (2,4,5- trimethoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cc(OC)c(cc1/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1C)C)OC

STK549217
Synonyms: 4- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(N/N=C/c2cccc(c2)[N+](=O)[O-])c2c(n1)cccc2)C

STK549218
Synonyms: methyl1- {[3- (pentafluorophenoxy)phenyl]carbamoyl}- D- prolinate
Smiles: COC(=O)[C@H]1CCCN1C(=O)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)F

STK549219
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549221
Synonyms: 11- butyl- 5- (methylsulfanyl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCCc1nc2sc3c(c2c2c1CCCC2)nc(n1c3nnc1)SC

STK549223
Synonyms: 4- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 6- methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)Cc1ccc2c(c1)OCO2)c1ccc(c(c1)OC)OC

STK549224
Synonyms: 5- (2- methoxyphenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)N(N=C2c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK549225
Synonyms: 6,6- dimethyl- 2- (methylsulfanyl)- N- (2- phenylethyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CSc1nc(NCCc2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK549226
Synonyms: 1- ethyl- 6- fluoro- 7- (4- {[(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]carbamothioyl}piperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1c(C)onc1c1ccccc1)c(c2)F

STK549227
Synonyms: 1- (3- hydroxypropyl)- 7,7- dimethyl- 2- phenyl- 1,5,7,8- tetrahydro- 4H- pyrano[4,3- d]pyrimidine- 4- thione
Smiles: OCCCn1c(nc(=S)c2c1CC(C)(C)OC2)c1ccccc1

STK549229
Synonyms: 2- [(E)- 2- (4- bromophenyl)ethenyl]- 3- (2- phenylethyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1CCc1ccccc1

STK549230
Synonyms: 3- (2- methylpropyl)- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(Cn1c(SC(C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1)C

STK549231
Synonyms: (2Z)- 2- (4- chlorobenzylidene)- 6- (3,4- dimethoxybenzyl)- 7H- [1,3]thiazolo[3,2- b][1,2,4]triazine- 3,7(2H)- dione
Smiles: COc1ccc(cc1OC)Cc1nn2c(nc1=O)s/c(=C\c1ccc(cc1)Cl)/c2=O

STK549232
Synonyms: 2- amino- 1- (2,4- dimethoxyphenyl)- N- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(c(c1)OC)n1c2nc3ccccc3nc2c(c1N)C(=O)NCCc1ccc(c(c1)OC)OC

STK549233
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(4- chlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2cccc(c2)[N+](=O)[O-])c2nonc2N)ccc1OCc1ccc(cc1)Cl

STK549234
Synonyms: 2- {[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3SCC(=O)Nc1cccc2c1cccc2)C

STK549235
Synonyms: N~2~,N~2~- dimethyl- N~4~- (3- methylphenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: Cc1cccc(c1)Nc1nc(nc(c1[N+](=O)[O-])N)N(C)C

STK549236
Synonyms: 9- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 8- methyl- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: C/C(=C\CSc1nc2sc3c(c2c(=O)n1C)CCc1c3cccc1)/Cl

STK549237
Synonyms: 2- (2- fluorophenyl)- 4- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]quinazoline
Smiles: Fc1ccccc1c1nc(N/N=C/c2ccc(cc2)[N+](=O)[O-])c2c(n1)cccc2

STK549238
Synonyms: 1- [(2- chlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccccc1Cl

STK549239
Synonyms: (5Z)- 5- [4- (dimethylamino)benzylidene]- 1- (2- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc(cc2)N(C)C)/C1=O

STK549240
Synonyms: N- {1- (3,5- dimethylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1n(c2cc(C)cc(c2)C)c2c(c1S(=O)(=O)c1ccc(cc1)C)nc1c(n2)cccc1

STK549241
Synonyms: 4- {[(6aS,6bR,9aS,10R)- 8- (2- methyl- 4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 10- yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1C)[N+](=O)[O-])C=Cc1c2cccc1

STK549242
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (3,4- dimethoxyphenyl)pyridin- 2- yl]sulfanyl}- N- (2,4- dimethylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2C)C)nc(c(c1c1ccc(c(c1)OC)OC)C#N)N

STK549244
Synonyms: 3- amino- N- tert- butyl- 4- (2- methoxyphenyl)- 6- phenylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1ccccc1c1cc(nc2c1c(N)c(s2)C(=O)NC(C)(C)C)c1ccccc1

STK549248
Synonyms: ethyl3- ({3- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]propanoyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)C(=O)c1ccco1)cc(cc2)OC

STK549249
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(1Z)- 1- (3,4- dichlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(\c1ccc(c(c1)Cl)Cl)/C)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK549250
Synonyms: 2- (3- chlorophenyl)- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: Clc1cccc(c1)c1nc2n(n1)cnc1c2C2(CCCCC2)Cc2c1cccc2

STK549252
Synonyms: 2- (3- chlorophenyl)- 8- cyclohexylidene- 3a,4,7,7a- tetrahydro- 1H- 4,7- methanoisoindole- 1,3(2H)- dione
Smiles: Clc1cccc(c1)N1C(=O)C2C(C1=O)C1C(=C3CCCCC3)C2C=C1

STK549254
Synonyms: 2- bromo- N- [(1E)- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 3- oxo- 1- (pyridin- 3- yl)prop- 1- en- 2- yl]benzamide
Smiles: O=C(/C(=C\c1cccnc1)/NC(=O)c1ccccc1Br)NCCc1c[nH]c2c1cccc2

STK549258
Synonyms: 3- [5- (2- chloro- 5- methylphenoxy)pentyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1cc(C)ccc1Cl

STK549259
Synonyms: N- [(Z)- {[(4- chlorophenyl)sulfonyl]imino}(phenyl)methyl]glycine
Smiles: OC(=O)CN/C(=N\S(=O)(=O)c1ccc(cc1)Cl)/c1ccccc1

STK549260
Synonyms: 2- imino- 10- methyl- 1- (4- methylbenzyl)- 3- [(4- methylphenyl)sulfonyl]- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: Cc1ccc(cc1)Cn1c2nc3c(C)cccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)C

STK549264
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK549265
Synonyms: 2- [(5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)NC(CCc1ccccc1)C)nn2)CC(OC3)(C)C

STK549266
Synonyms: 8- (4- benzylpiperazin- 1- yl)- 5- nitroquinoline
Smiles: [O-][N+](=O)c1ccc(c2c1cccn2)N1CCN(CC1)Cc1ccccc1

STK549268
Synonyms: (6aR,6bS,9aR,10S)- 8- (3- bromophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Brc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK549269
Synonyms: 6- ethyl- 6,12- dimethyl- 9- (methylsulfanyl)- 6,12- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n1c(n2C)nnc1SC

STK549272
Synonyms: N- (3- chloro- 4- methylphenyl)- 10- methyl- 11- (3- nitrophenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1cccc(c1)[N+](=O)[O-])n1c(=N2)c(Nc2ccc(c(c2)Cl)C)nc2c1cccc2)c1ccccc1

STK549273
Synonyms: 2- (hexylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCCCCCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549275
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 11- propyl- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCc1c(Cl)cccc1Cl

STK549276
Synonyms: 3- benzyl- 6- iodo- 2- (pentylsulfanyl)quinazolin- 4(3H)- one
Smiles: CCCCCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I

STK549278
Synonyms: N- (3- bromo- 4- methylphenyl)- 7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCN(CC1)c1cc(Nc2ccc(c(c2)Br)C)c(c2c1non2)[N+](=O)[O-]

STK549279
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)CCC

STK549280
Synonyms: propan- 2- yl2- amino- 1- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK549281
Synonyms: 2- (propoxycarbonyl)phenyl4- (3- nitrophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: CCCOC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)[N+](=O)[O-]

STK549282
Synonyms: N- (naphthalen- 1- yl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK549283
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2- methoxynaphthalen- 1- yl)methylidene]acetohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)CSc1nnc(n1CC)c1ccc(cc1)C(C)(C)C)cccc2

STK549284
Synonyms: diethyl1,1'- (7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine- 2,4- diyl)bis(5- amino- 1H- pyrazole- 4- carboxylate)
Smiles: CCOC(=O)c1cnn(c1N)c1nc2sc3c(c2c(n1)n1ncc(c1N)C(=O)OCC)CCC(C3)C

STK549285
Synonyms: N- {1,1,1,3,3,3- hexafluoro- 2- [(6- nitro- 1,3- benzothiazol- 2- yl)amino]propan- 2- yl}pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NC(C(F)(F)F)(C(F)(F)F)Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]

STK549286
Synonyms: N- (4- chlorophenyl)- 11- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Cl)c1ccccc1

STK549288
Synonyms: 3- [3- (2- chloro- 4,6- dimethylphenoxy)propyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Cl)C

STK549289
Synonyms: methyl(2E)- [2- (4- chlorophenyl)hydrazinylidene][(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethanoate
Smiles: COC(=O)/C(=N\Nc1ccc(cc1)Cl)/Sc1nnnn1c1ccccc1

STK549291
Synonyms: 2- ({4- amino- 6- [(2- fluorophenyl)amino]- 5- nitropyrimidin- 2- yl}amino)ethanol
Smiles: OCCNc1nc(Nc2ccccc2F)c(c(n1)N)[N+](=O)[O-]

STK549292
Synonyms: (2'R,3'R)- 2'- (2,3- dimethoxyphenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1c(OC)cccc1[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK549294
Synonyms: {[3- (2- methylpropyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK549295
Synonyms: 7- (pentylsulfanyl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCSc1ncnc2c1sc1c2c2CCCc2c(n1)C(C)C

STK549296
Synonyms: 3- (5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexan]- 2- yl)phenol
Smiles: Oc1cccc(c1)c1nc2n(n1)cnc1c2C2(CCCCC2)Cc2c1cccc2

STK549297
Synonyms: 3- (furan- 2- ylmethyl)- 2- (pentylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549299
Synonyms: 4- (2,4- dichlorophenoxy)- 2- (2- fluorophenyl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)Oc1nc(nc2c1cccc2)c1ccccc1F

STK549301
Synonyms: (6aR,6bS,9aR,10S)- 8- (2,4- dimethoxyphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: COc1ccc(c(c1)OC)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK549303
Synonyms: (8S,8aR,11aS,11bS)- 10- (2- chlorophenyl)- 8- (2,2- dimethylpropanoyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)C(C)(C)C)C=Cc2c1cccc2

STK549304
Synonyms: N- {(1E)- 1- (3,4- diethoxyphenyl)- 3- [(2- hydroxyethyl)amino]- 3- oxoprop- 1- en- 2- yl}- 4- methylbenzamide
Smiles: OCCNC(=O)/C(=C\c1ccc(c(c1)OCC)OCC)/NC(=O)c1ccc(cc1)C

STK549305
Synonyms: (5Z)- 5- ({1- [3- (3,5- dimethylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1cc(OCCCn2cc(c3c2cccc3)/C=C\2/C(=O)NC(=O)N(C2=O)Cc2ccco2)cc(c1)C

STK549306
Synonyms: 3- (2- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccccc1n1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549307
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3- chloro- 4- fluorophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)Cl)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK549308
Synonyms: methyl4- [3- (4- hydroxy- 3- methoxyphenyl)- 4,6- dioxo- 2- phenylhexahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)OC)O

STK549309
Synonyms: tert- butyl(2''R,3''R)- 2''- (3,4- dimethoxyphenyl)- 4',6'- dioxo- 2'',3''- dihydro- 10b''H- dispiro[cyclohexane- 1,2'- [1,3]dioxane- 5',1''- pyrrolo[2,1- a]phthalazine]- 3''- carboxylate
Smiles: COc1cc(ccc1OC)[C@H]1[C@H](C(=O)OC(C)(C)C)N2C(C31C(=O)OC1(OC3=O)CCCCC1)c1ccccc1C=N2

STK549310
Synonyms: (2E)- 3- {[4- chloro- 2- (trifluoromethyl)phenyl]amino}- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(F)(F)F)Cl)/c1scc(n1)c1ccc(cc1)CC(C)C

STK549311
Synonyms: N- [(4E)- 8- ethoxy- 6- (4- ethoxyphenyl)- 1,3- dimethyl- 4H- cyclohepta[c]furan- 4- ylidene]benzene- 1,2- diamine
Smiles: CCOc1ccc(cc1)c1c/c(=N\c2ccccc2N)/c2c(c(c1)OCC)c(oc2C)C

STK549312
Synonyms: 1- [5- (3- fluorophenyl)- 1,3,4- thiadiazol- 2- yl]- 3- (2- methylphenyl)urea
Smiles: O=C(Nc1ccccc1C)Nc1nnc(s1)c1cccc(c1)F

STK549313
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [2- (4- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK549315
Synonyms: 3- butyl- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCn1c(SC(C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549316
Synonyms: 4- chloro- 2- (pyridin- 2- yl)quinazoline
Smiles: Clc1nc(nc2c1cccc2)c1ccccn1

STK549317
Synonyms: 10- methyl- N- (3- methylphenyl)- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1

STK549318
Synonyms: 3- [(3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- 1- phenylpyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccccc1)Cn1nc(cc1C)C

STK549320
Synonyms: 7- (4- chlorophenyl)- 3- (3- nitrophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Clc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK549321
Synonyms: N,N- dibutyl- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)CCCC

STK549322
Synonyms: (4bR,7aS,8R)- 6- (3- bromophenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Brc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2C=CC=N1)C(=O)c1ccccc1

STK549324
Synonyms: (5Z)- 5- [(1- {2- [2- (butan- 2- yl)phenoxy]ethyl}- 1H- indol- 3- yl)methylidene]- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F)C

STK549325
Synonyms: 3,3'- sulfonylbis{6- chloro- N- [4- (diethylamino)phenyl]benzenesulfonamide}
Smiles: CCN(c1ccc(cc1)NS(=O)(=O)c1cc(ccc1Cl)S(=O)(=O)c1ccc(c(c1)S(=O)(=O)Nc1ccc(cc1)N(CC)CC)Cl)CC

STK549326
Synonyms: N- (3,5- dimethylphenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)cc(c1)C)nc1c2cccc1

STK549327
Synonyms: (5Z)- 5- (4- hydroxy- 3- methoxybenzylidene)- 3- (naphthalen- 2- yl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)c1ccc2c(c1)cccc2

STK549328
Synonyms: (4bR,7aS,8R)- 6- (4- nitrophenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@@H](N1C2C=CC=N1)C(=O)c1ccccc1

STK549329
Synonyms: N'- [(1Z)- 3,5- diphenylcyclohex- 2- en- 1- ylidene]- 4- methoxybenzohydrazide
Smiles: COc1ccc(cc1)C(=O)N/N=C\1/CC(CC(=C1)c1ccccc1)c1ccccc1

STK549330
Synonyms: 4- fluoro- N- [(2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)F)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK549331
Synonyms: (5Z)- 5- ({1- [2- (4- bromophenoxy)ethyl]- 1H- pyrrol- 2- yl}methylidene)- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cccn2CCOc2ccc(cc2)Br)/C1=O

STK549332
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(1E,2E)- 3- (furan- 2- yl)- 2- methylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)Cl)N/N=C/C(=C/c1ccco1)/C

STK549335
Synonyms: ethyl7- {[(4- benzylpiperidin- 1- yl)acetyl]amino}- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cc1c(c2)OCO1

STK549336
Synonyms: (2Z)- 2- cyano- N- (furan- 2- ylmethyl)- 2- [(5Z)- 5- (3- nitrobenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=c\1/s/c(=C\c2cccc(c2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)NCc1ccco1

STK549337
Synonyms: (3Z)- 3- [(3- bromophenyl)imino]- 1- [(4- phenylpiperazin- 1- yl)methyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: Brc1cccc(c1)/N=C\1/c2ccccc2N(C1=O)CN1CCN(CC1)c1ccccc1

STK549339
Synonyms: 2- [(3- ethyl- 6- iodo- 4- oxo- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: CCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)cc(cc2)I

STK549341
Synonyms: 3- benzyl- 6- iodo- 2- {[2- (morpholin- 4- yl)- 2- oxoethyl]sulfanyl}quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)N1CCOCC1)Cc1ccccc1

STK549342
Synonyms: (6aS,6bR,9aS,10R)- 8- (3- fluorophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK549344
Synonyms: propan- 2- yl2- amino- 1- (4- chloro- 3- nitrophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl)C

STK549345
Synonyms: 10- (4- methylphenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: Cc1ccc(cc1)n1c2ccccc2cc2c1nc(=O)[nH]c2=O

STK549347
Synonyms: N,N- dibutyl- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCC3)CCCC

STK549348
Synonyms: 2- amino- N- [2- (3,4- dimethoxyphenyl)ethyl]- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccc(c(c1)OC)OC

STK549349
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1Z)- 1- (3,4- dimethoxyphenyl)ethylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(ccc1OC)/C(=N\NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N)/C

STK549350
Synonyms: 3- [5- (3- bromophenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazol- 3- yl]- 6- chloro- 4- phenylquinolin- 2(1H)- one
Smiles: Brc1cccc(c1)C1CC(=NN1c1ccccc1)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK549351
Synonyms: 9- (3- methylphenyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: Cc1cccc(c1)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK549352
Synonyms: (4aS,4bR,7aS,8R)- 6- (1,3- benzodioxol- 5- yl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C([C@@H]1N2N=CC=C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)c1cccc(c1)[N+](=O)[O-]

STK549354
Synonyms: 4- {6- [(4- ethoxyphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C

STK549355
Synonyms: 8- methoxy- 2- methyl- 3- ({(E)- [4- (methylsulfanyl)phenyl]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)SC

STK549357
Synonyms: (5Z)- 1- (3- chloro- 4- methoxyphenyl)- 5- {[1- (3- phenoxypropyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccccc2)/C1=O

STK549358
Synonyms: 4- (3- methylphenyl)- 1- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SC/C=C/c3ccccc3)nnc2n(c1=O)c1cccc(c1)C)C

STK549359
Synonyms: (4aS,4bR,7aS,8R)- 6- (4- chlorophenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK549363
Synonyms: 6- iodo- 3- (naphthalen- 2- yl)- 2- [(E)- 2- (3- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)cccc2

STK549364
Synonyms: 4- {6- [(3- chloro- 4- methylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)O)O)n1c(=N2)c(Nc2ccc(c(c2)Cl)C)nc2c1cccc2)c1ccccc1

STK549365
Synonyms: ethyl4- {[11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccco2)c(nn1c1ccccc1)C

STK549367
Synonyms: 3- benzyl- 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 6- iodoquinazolin- 4(3H)- one
Smiles: C/C(=C\CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I)/Cl

STK549368
Synonyms: (5Z)- 3- (2- bromophenyl)- 5- (2- methoxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK549369
Synonyms: (5E)- 5- [4- (dimethylamino)- 3- nitrobenzylidene]- 1- (2,4- dimethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)[N+](=O)[O-])N(C)C)/C1=O

STK549370
Synonyms: 1- (4- methylphenoxy)- 3- (pyrrolidin- 1- yl)propan- 2- ol
Smiles: OC(CN1CCCC1)COc1ccc(cc1)C

STK549372
Synonyms: dimethyl5- ({(Z)- 2- cyano- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzene- 1,3- dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1ccc(cc1)CC

STK549374
Synonyms: 8- methyl- 9- (pentylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1C)CCc1c3cccc1

STK549376
Synonyms: 6- iodo- 3- (naphthalen- 1- yl)- 2- [(E)- 2- phenylethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1)c1cccc2c1cccc2

STK549377
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- (furan- 2- ylmethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549378
Synonyms: 3- [4- (dimethylamino)phenyl]- 5- (4- fluorophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)N(C)C

STK549379
Synonyms: 11- (1,3- benzodioxol- 5- ylmethyl)- 2- methyl- 3- (prop- 2- en- 1- yl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: C=CCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK549380
Synonyms: 3- [4- (2- chloro- 5- methylphenoxy)butyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1cc(C)ccc1Cl

STK549381
Synonyms: 3- bromo- N- [2- (dipropan- 2- ylamino)ethyl]- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: CC(N(C(C)C)CCNC(=O)c1coc(=O)c(c1)Br)C

STK549382
Synonyms: ethyl4- {[11- (3- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)OC)c(nn1c1ccccc1)C

STK549383
Synonyms: 2,2,5- trimethyl- 10- (methylsulfanyl)- N- (tetrahydrofuran- 2- ylmethyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- amine
Smiles: CSc1nc(NCC2CCCO2)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)C

STK549384
Synonyms: 11- (4- ethoxyphenyl)- 10- methyl- N- (3- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)C)nc1c2cccc1

STK549386
Synonyms: N- (3- bromo- 4- methylphenyl)- 7- (3- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCCN(C1)c1cc(Nc2ccc(c(c2)Br)C)c(c2c1non2)[N+](=O)[O-]

STK549387
Synonyms: 4- [3,5,6- trifluoro- 4- (2- nitrophenoxy)pyridin- 2- yl]morpholine
Smiles: Fc1nc(N2CCOCC2)c(c(c1F)Oc1ccccc1[N+](=O)[O-])F

STK549388
Synonyms: N- (4- chlorophenyl)- 2- [(5- oxo- 4- phenyl- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3

STK549389
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)Br)c1ccncc1

STK549390
Synonyms: 1- (4- chlorophenyl)- 2- [(2- ethyl- 6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]ethanone
Smiles: CCc1nc(SCC(=O)c2ccc(cc2)Cl)c2c(n1)sc1c2CCC1

STK549394
Synonyms: [2- (piperidin- 1- yl)quinolin- 3- yl]methanol
Smiles: OCc1cc2ccccc2nc1N1CCCCC1

STK549395
Synonyms: 2- amino- 1- [2- (3,4- dimethoxyphenyl)ethyl]- N- (4- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

STK549396
Synonyms: 3- (2- methylpropyl)- 2- (methylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCCC3

STK549399
Synonyms: (5Z)- 3- (2- chlorophenyl)- 5- (3- fluorobenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Fc1cccc(c1)/C=C/1\SC(=S)N(C1=O)c1ccccc1Cl

STK549400
Synonyms: (9E)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 3- (4- methoxyphenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: COc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccc(cc1)F)CN(C/C/3=C\c1ccc(cc1)F)C

STK549401
Synonyms: 5- ethyl- 10,10- dimethyl- 3- (propylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK549402
Synonyms: 3- (2,5- dimethylphenyl)- 11- (3- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1ccc(c(c1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C)C

STK549403
Synonyms: ethyl{[4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1ncnc2c1sc1c2c2CCCc2c(n1)C(C)C

STK549404
Synonyms: (6aR,6bS,9aR,10S)- 8- (4- chlorophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK549405
Synonyms: 6,6- dimethyl- 3- (3- methylphenyl)- 2- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SC/C=C/c2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK549408
Synonyms: 2- (4- chlorophenyl)- 3- [5- (3- methylphenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1cccc(c1)C

STK549409
Synonyms: 5- bromo- 4- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 2- chloropyrimidine
Smiles: Brc1ccc(cc1)/C=N/Nc1nc(Cl)ncc1Br

STK549410
Synonyms: 3,3'- {sulfonylbis[(2- chlorobenzene- 4,1- diyl)oxy]}bis[1- (pyrrolidin- 1- yl)propan- 2- ol]
Smiles: OC(CN1CCCC1)COc1ccc(cc1Cl)S(=O)(=O)c1ccc(c(c1)Cl)OCC(CN1CCCC1)O

STK549411
Synonyms: 2- methoxyethyl2- amino- 1- (2- ethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccccc1OCC

STK549413
Synonyms: 5- (2- chlorophenyl)- 3- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccccc1c1nc2sc3c(c2c2n1c(SC/C=C/c1ccccc1)nn2)CCCC3

STK549414
Synonyms: N- (4- ethoxyphenyl)- 11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)F)c(nn1c1ccccc1)C

STK549416
Synonyms: (2E)- 2- [(5E)- 5- benzylidene- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- N- (3- chlorophenyl)- 2- cyanoethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccccc2)/c(=O)n1c1ccccc1)/C(=O)Nc1cccc(c1)Cl

STK549417
Synonyms: 3- bromo- N- (3- nitrophenyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)Nc1cccc(c1)[N+](=O)[O-]

STK549418
Synonyms: (2'R,3'R)- 2'- (4- methoxyphenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK549419
Synonyms: 3,7- bis[(3- nitrophenyl)carbonyl]- 1,5- dipropyl- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: CCCC12CN(CC(C2=O)(CN(C1)C(=O)c1cccc(c1)[N+](=O)[O-])CCC)C(=O)c1cccc(c1)[N+](=O)[O-]

STK549420
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(s2)SCc2ccccc2)cc(c1OC)OC

STK549421
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [2- (4- methoxyphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK549422
Synonyms: 4- [(E)- {2- [4- (3- chlorophenyl)piperazin- 1- yl]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}methyl]phenylbenzenesulfonate
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK549423
Synonyms: N- (4- methoxyphenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK549425
Synonyms: 2- (trichloromethyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: ClC(c1nn2c(n1)c1c(nc2)sc2c1CCCC2)(Cl)Cl

STK549428
Synonyms: 1- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CC(OCc3sc2n2c1nnc2SCC(=O)c1ccc(cc1)F)C(C)C

STK549429
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SCc1c(Cl)cccc1Cl)nn2)CC(OC3)(C)C

STK549430
Synonyms: ethyl(2E)- cyano[5- (2- hydroxyethyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanoate
Smiles: OCCC1S/C(=C(/C(=O)OCC)\C#N)/N(C1=O)c1ccccc1

STK549431
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(E)- pyridin- 4- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)Cl)N/N=C/c1ccncc1

STK549432
Synonyms: 2- [(2,2- diethoxyethyl)sulfanyl]- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCOC(CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1)OCC

STK549434
Synonyms: 4- butyl- N- pentyl- 2,3,5a,10b- tetrahydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CCCCCNc1ncnc2c1SC1C2C2=C(C(=N1)CCCC)CCC2

STK549435
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(2- methylbenzyl)oxy]phenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCOCC2)c2nonc2N)ccc1OCc1ccccc1C

STK549437
Synonyms: 2- (4- ethylpiperazin- 1- yl)- N- (4- methoxyphenyl)- 5- nitropyrimidine- 4,6- diamine
Smiles: CCN1CCN(CC1)c1nc(Nc2ccc(cc2)OC)c(c(n1)N)[N+](=O)[O-]

STK549438
Synonyms: N- (2- methoxyphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549439
Synonyms: 1- [(4- bromobenzyl)sulfanyl]- 4- (4- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n2c1nnc2SCc1ccc(cc1)Br

STK549440
Synonyms: 2- methoxyethyl6- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)Br

STK549441
Synonyms: 6- bromo- 2- [5- (4- bromophenyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]- 4- phenylquinazoline
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)c1nc2ccc(cc2c(n1)c1ccccc1)Br

STK549442
Synonyms: 3- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 8- fluoro- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)F

STK549443
Synonyms: 4- {[(6aS,6bR,9aS,10R)- 8- (2- methoxy- 5- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 10- yl]carbonyl}phenylacetate
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1ccc(cc1)OC(=O)C)[N+](=O)[O-]

STK549444
Synonyms: 4- (2- methylpropyl)- N- [2- (morpholin- 4- yl)ethyl]- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3NCCN1CCOCC1)C

STK549445
Synonyms: 2- (benzylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549446
Synonyms: N- (4- bromophenyl)- 2- [(5- oxo- 4- phenyl- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3

STK549447
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- ({1- [3- (2- methylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccccc2C)/C1=O

STK549448
Synonyms: N'- [11- (3,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]- N,N- diethylbenzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)OC)OC)c(nn1c1ccccc1)C)CC

STK549449
Synonyms: 5- (4- fluorophenyl)- 3- (4- hydroxyphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Oc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(cc1)F

STK549451
Synonyms: 6,6- dimethyl- 2- (methylsulfanyl)- 4- (propylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCSc1nc(SC)nc2c1c1CC(C)(C)OCc1s2

STK549452
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- ({1- [2- (2- methoxyphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK549453
Synonyms: 3- (furan- 2- yl)- 1- (methylsulfonyl)- 5- (3- nitrophenyl)- 4,5- dihydro- 1H- pyrazole
Smiles: [O-][N+](=O)c1cccc(c1)C1CC(=NN1S(=O)(=O)C)c1ccco1

STK549454
Synonyms: N- cyclohexyl- 2- imino- 1,10- dimethyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)NC1CCCCC1

STK549457
Synonyms: 2- methoxy- 6- [4- (4- phenylpiperazin- 1- yl)quinazolin- 2- yl]phenol
Smiles: COc1cccc(c1O)c1nc(N2CCN(CC2)c2ccccc2)c2c(n1)cccc2

STK549458
Synonyms: 2- {[10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- 1- (4- nitrophenyl)ethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)[N+](=O)[O-])nn2)CC(OC3)(C)C

STK549459
Synonyms: (5Z)- 2- [(2- chlorophenyl)amino]- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 1,3- thiazol- 4(5H)- one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=NC1=O)Nc1ccccc1Cl

STK549460
Synonyms: 4- butoxy- N'- [2- (methylsulfanyl)- 6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CCCCOc1ccc(cc1)C(=O)NNc1nc(SC)nc2c1c1CCCc1s2

STK549461
Synonyms: ethyl4- ({[1- amino- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinolin- 2- yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK549462
Synonyms: ethyl3- ({3- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]propanoyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)cc(cc2)OC

STK549463
Synonyms: N~4~- (3- methylphenyl)- 5- nitro- N~2~- (tetrahydrofuran- 2- ylmethyl)pyrimidine- 2,4,6- triamine
Smiles: Cc1cccc(c1)Nc1nc(NCC2CCCO2)nc(c1[N+](=O)[O-])N

STK549468
Synonyms: (5Z)- 5- {3- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methoxybenzylidene}- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1

STK549471
Synonyms: (5Z)- 5- [(1- {2- [4- (butan- 2- yl)phenoxy]ethyl}- 1H- pyrrol- 2- yl)methylidene]- 1- (3- chloro- 4- methoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)OCCn1cccc1/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)OC)C

STK549473
Synonyms: 1- (3- methylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C

STK549474
Synonyms: N- (4- methoxyphenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)OC(C)C

STK549477
Synonyms: N- (4- chlorophenyl)- 11- (3,4- dichlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)Cl)Cl)C)c1ccccc1

STK549478
Synonyms: ethyl3- ({3- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)cccc2

STK549480
Synonyms: 9- bromo- 5- (3,4- difluorophenyl)- 2- (thiophen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: Brc1ccc2c(c1)C1CC(=NN1C(O2)c1ccc(c(c1)F)F)c1cccs1

STK549483
Synonyms: 2- hydroxy- N- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]benzamide
Smiles: CSc1nnc(s1)NC(=O)c1ccccc1O

STK549484
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(2Z)- butan- 2- ylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC/C(=N\NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N)/C

STK549486
Synonyms: 2- (2- bromophenyl)- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: Brc1ccccc1c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2

STK549487
Synonyms: 3- [(4- fluorobenzyl)sulfanyl]- 10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)F)nn2)CC(OC3)(C)C

STK549488
Synonyms: (2E)- 2- [4- (4- methylphenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(cc1)C

STK549489
Synonyms: methyl4- {6- [(4- bromophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1)Br)nc1c2cccc1

STK549491
Synonyms: 3- methyl- 7- {[2- (pyrrolidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)NCCN1CCCC1)c(=O)c1c(c2=O)cccc1

STK549492
Synonyms: (6aS,6bR,9aS,10R)- 8- (naphthalen- 1- yl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc3c1cccc3)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK549493
Synonyms: 3- chloro- N- (2,6- dichlorophenyl)- 2,5,6- trifluoropyridin- 4- amine
Smiles: Clc1cccc(c1Nc1c(F)c(F)nc(c1Cl)F)Cl

STK549494
Synonyms: 4- chloro- N- [2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2

STK549495
Synonyms: 8- chloro- 10- (4- fluorophenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: Fc1ccc(cc1)n1c2cc(Cl)ccc2cc2c1nc(=O)[nH]c2=O

STK549496
Synonyms: (5Z)- 1- (4- ethylphenyl)- 5- ({1- [2- (4- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(cc2)C)/C1=O

STK549497
Synonyms: 2- (4- butoxyphenyl)- 6,6- dimethyl- 4- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SC/C=C/c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK549498
Synonyms: 4- [(2E)- 2- (2- fluorobenzylidene)hydrazinyl]- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1F

STK549499
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(5- methoxy- 2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)Br

STK549500
Synonyms: 1- (4- bromophenyl)- 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}ethanone
Smiles: CSc1nc(SCC(=O)c2ccc(cc2)Br)c2c(n1)sc1c2CCCC1

STK549501
Synonyms: 3- (furan- 2- ylmethyl)- 2- (methylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549503
Synonyms: 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: Cc1cccc(c1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549506
Synonyms: 3- [(4- methylphenyl)sulfonyl]- 1- phenyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c2nc3ccccc3nc2n(c1N)c1ccccc1

STK549507
Synonyms: 4- (biphenyl- 4- yloxy)- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccccc1c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2

STK549508
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [2- (2- chlorophenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCOc1ccccc1Cl)c1ccc(c(c1)Cl)C

STK549509
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C)C

STK549510
Synonyms: 2,4- bis(5- chloro- 2- nitrophenoxy)- 3,5,6- trifluoropyridine
Smiles: Clc1ccc(c(c1)Oc1nc(F)c(c(c1F)Oc1cc(Cl)ccc1[N+](=O)[O-])F)[N+](=O)[O-]

STK549512
Synonyms: 1,3- diethyl- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- ylacetyl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: CCn1c(O)c(C(=O)CC2NCCc3c2cccc3)c(=O)n(c1=S)CC

STK549513
Synonyms: 1- (piperidin- 1- yl)- 3- (2,4,6- trichlorophenoxy)propan- 2- ol
Smiles: OC(CN1CCCCC1)COc1c(Cl)cc(cc1Cl)Cl

STK549515
Synonyms: N- benzyl- 2- imino- 1- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1)NCc1ccccc1

STK549517
Synonyms: N'- [11- (4- tert- butylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]- N,N- diethylbenzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C)CC

STK549520
Synonyms: 2- (prop- 2- en- 1- ylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCC=C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549521
Synonyms: 10- methyl- N,8- diphenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1cc(cc(c1OC)OC)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccccc1)nc1c2cccc1

STK549522
Synonyms: N- {[2- (furan- 2- ylcarbonyl)hydrazinyl]carbonothioyl}- 5- methyl- 3- phenyl- 1,2- oxazole- 4- carboxamide
Smiles: S=C(NC(=O)c1c(C)onc1c1ccccc1)NNC(=O)c1ccco1

STK549524
Synonyms: (8R,8aS,11aR)- 8- acetyl- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)C

STK549526
Synonyms: ethyl5- methoxy- 3- {[3- (pyrrolidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCCC1)cc(cc2)OC

STK549527
Synonyms: N- (1- phenylpropan- 2- yl)- 2- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl)sulfanyl]acetamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)NC(Cc1ccccc1)C

STK549528
Synonyms: 4- ({[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}methyl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)CSc1nnc(s1)SCc1ccccc1

STK549530
Synonyms: ethyl1,2- dimethyl- 5- {2- oxo- 2- [(2Z)- 2- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]ethoxy}- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)N/N=C/1\C(=O)Nc3c1cccc3)cc2)C

STK549531
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- ({1- [3- (4- methylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(cc1)OCCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK549533
Synonyms: (5- bromofuran- 2- yl)[5- (4- bromophenyl)- 3'- (4- methylphenyl)- 1'- phenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]methanone
Smiles: Brc1ccc(o1)C(=O)N1N=C(CC1c1cn(nc1c1ccc(cc1)C)c1ccccc1)c1ccc(cc1)Br

STK549535
Synonyms: 2- [4- (2,6- dimethylmorpholin- 4- yl)quinazolin- 2- yl]- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc2ccccc2c(n1)N1CC(C)OC(C1)C

STK549536
Synonyms: 3- {[(E)- (5- chloro- 2- hydroxy- 3- nitrophenyl)methylidene]amino}- 2- methylquinazolin- 4(3H)- one
Smiles: Clc1cc(/C=N/n2c(C)nc3c(c2=O)cccc3)c(c(c1)[N+](=O)[O-])O

STK549538
Synonyms: 5- ethyl- 3- (prop- 2- en- 1- ylsulfanyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: C=CCSc1nnc2n1c(CC)nc1c2c2CCCc2s1

STK549540
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- (4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@H]2[C@@H]1[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C

STK549541
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (3- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1cccc(c1)n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549542
Synonyms: 3- [(3- fluorobenzyl)sulfanyl]- 5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1cccc(c1)F)nn2)CCCC3

STK549544
Synonyms: 2- (4- chlorophenyl)- 3- {2- [2- (4- iodophenoxy)ethoxy]ethyl}quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccc(cc1)I

STK549546
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- methoxy- 3- [(2,4,6- trichlorophenoxy)methyl]phenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1COc1c(Cl)cc(cc1Cl)Cl)/C=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK549547
Synonyms: N- (4- bromophenyl)- 2- (pyridin- 2- yl)quinazolin- 4- amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccccn1

STK549549
Synonyms: 2- methoxyethyl2- amino- 1- (2,3- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1C)C

STK549551
Synonyms: ethyl7- chloro- 3- methyl- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1C)cccc2Cl

STK549553
Synonyms: ethyl3- {[2- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC(CC1)Cc1ccccc1)C)cc(c(c2)OC)OC

STK549554
Synonyms: 5- [4- (hexyloxy)phenyl]- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCCCCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK549555
Synonyms: N~2~- [3- (dimethylamino)propyl]- N~4~- (3- methylphenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: CN(CCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-])C

STK549556
Synonyms: (2Z)- 1- acetyl- 2- {[6- methyl- 2- (piperidin- 1- yl)quinolin- 3- yl]methylidene}- 1,2- dihydro- 3H- indol- 3- one
Smiles: Cc1ccc2c(c1)cc(c(n2)N1CCCCC1)/C=C/1\N(C(=O)C)c2c(C1=O)cccc2

STK549558
Synonyms: 3- bromo- 2- oxo- N- [(1R)- 1- phenylethyl]- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)N[C@@H](c1ccccc1)C

STK549559
Synonyms: 1- [4- (acetylamino)phenyl]- 2- amino- N- butyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)NC(=O)C

STK549562
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[2,5- dimethyl- 1- (naphthalen- 1- yl)- 1H- pyrrol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc(n(c2C)c2cccc3c2cccc3)C)/C1=O)C

STK549563
Synonyms: (4bR,7aS,8R)- 6- (naphthalen- 2- yl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C([C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)c1ccccc1

STK549564
Synonyms: 11- (3- methoxypropyl)- 2- methyl- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCCn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK549565
Synonyms: N'- [11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]- N,N- diethylbenzene- 1,4- diamine
Smiles: CCOc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)N(CC)CC)c1ccccc1

STK549566
Synonyms: (2E)- 3- (4- fluorophenyl)- N- [(2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]prop- 2- enamide
Smiles: S=C(NC(=O)/C=C/c1ccc(cc1)F)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK549568
Synonyms: 2- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 7- tert- butyl- 3- (3- methylphenyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Cc1cccc(c1)n1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C

STK549569
Synonyms: (8R,8aS,11aR)- 10- (2,4- dimethoxyphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1OC)OC)cccc3

STK549570
Synonyms: 2- (1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)- N'- [(E)- (4- methylphenyl)methylidene]acetohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

STK549571
Synonyms: 2- benzyl- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: c1ccc(cc1)Cc1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2

STK549572
Synonyms: 4- (6- {[4- (diethylamino)phenyl]amino}- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl)- 2- methoxyphenol
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)OC)O)c(nn1c1ccccc1)C)CC

STK549573
Synonyms: 4- butyl- N- cyclohexyl- 2,3,5a,10b- tetrahydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3NC1CCCCC1

STK549574
Synonyms: 2- ({5- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- sulfamoylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1CSc1nc2c(s1)cccc2

STK549575
Synonyms: 5- ethyl- 3- (heptylsulfanyl)- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCCCCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK549576
Synonyms: 3- (3- chlorophenyl)- 1- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: Clc1cccc(c1)n1c(=O)c2c3CCCCc3sc2n(c1=O)C

STK549578
Synonyms: (4bR,7aS,8R)- 6- (2,4- dichlorophenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Clc1ccc(c(c1)Cl)N1C(=O)[C@H]2[C@@H](C1=O)C1N([C@H]2C(=O)c2ccccc2)N=CC=C1

STK549580
Synonyms: 4- butoxy- N'- [2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CCCCOc1ccc(cc1)C(=O)NNc1nc(SC)nc2c1c1CCCCc1s2

STK549581
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK549582
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2- methoxy- 5- nitrophenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2)[N+](=O)[O-]

STK549583
Synonyms: 4- [4- (2,3,5,6- tetrafluoropyridin- 4- yl)piperazin- 1- yl]aniline
Smiles: Nc1ccc(cc1)N1CCN(CC1)c1c(F)c(F)nc(c1F)F

STK549585
Synonyms: 4- methyl- N- (naphthalen- 1- yl)- 3- [4- (propan- 2- yloxy)phenyl]pentanamide
Smiles: O=C(Nc1cccc2c1cccc2)CC(c1ccc(cc1)OC(C)C)C(C)C

STK549587
Synonyms: 11- (4- methoxybenzyl)- 3- (2- methoxyphenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)Cn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1OC

STK549588
Synonyms: (5Z)- 2- [(4- methylphenyl)amino]- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2ccc(cc2)C)cc(c1OC)OC

STK549589
Synonyms: 12- benzyl- 9- (benzylsulfanyl)- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclohexan]- 7(12H)- one
Smiles: O=c1n2c(SCc3ccccc3)nnc2n(c2c1C1(CCCCC1)Cc1c2cccc1)Cc1ccccc1

STK549591
Synonyms: 3- acetyl- 5- (2- methoxyphenyl)- 1- (3- methylphenyl)- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)N(N=C2C(=O)C)c1cccc(c1)C

STK549592
Synonyms: (5Z)- 3- (2- bromophenyl)- 5- (4- ethoxy- 3- methoxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK549593
Synonyms: 2- amino- N- (3- methylphenyl)- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK549595
Synonyms: (4aS,4bR,7aS,8R)- 6- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK549596
Synonyms: 4- (biphenyl- 4- yloxy)- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2)C

STK549597
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- bromo- 5- ethoxy- 4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OCc1cccc2c1cccc2)Br

STK549599
Synonyms: (2E)- 2- cyano- N- (3,4- dichlorophenyl)- 2- [(5E)- 5- (2- methoxybenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccccc2OC)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(c(c1)Cl)Cl

STK549600
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (3,5- dimethylpiperidin- 1- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CC(C)CC(C1)C)c(n2Cc1ccccc1)C

STK549601
Synonyms: 5- (4- bromophenyl)- 1- (4- nitrophenyl)- 3- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK549602
Synonyms: methyl{[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(SC)nc2c1c1CCCCc1s2

STK549603
Synonyms: N- {3- (2- methoxyphenyl)- 3- [4- (propan- 2- yloxy)phenyl]propyl}thiophene- 2- carboxamide
Smiles: COc1ccccc1C(c1ccc(cc1)OC(C)C)CCNC(=O)c1cccs1

STK549604
Synonyms: methyl4- {6- [(4- chlorophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1)Cl)nc1c2cccc1

STK549605
Synonyms: (4bR,7aS,8R)- 8- [(4- methoxyphenyl)carbonyl]- 6- (naphthalen- 2- yl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2

STK549606
Synonyms: 2- chloro- 10- [3- chloro- 2,5- difluoro- 6- (piperidin- 1- yl)pyridin- 4- yl]- 10H- phenothiazine
Smiles: Clc1ccc2c(c1)N(c1c(F)c(nc(c1Cl)F)N1CCCCC1)c1c(S2)cccc1

STK549607
Synonyms: 2- (4- butoxyphenyl)- 6,6- dimethyl- 4- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK549608
Synonyms: 2- (4- ethylphenyl)- 5,6- diphenyl- 1- (2- phenylethyl)- 1H- imidazo[1,2- a]imidazole
Smiles: CCc1ccc(cc1)c1cn2c(n1CCc1ccccc1)nc(c2c1ccccc1)c1ccccc1

STK549609
Synonyms: 5- (4- fluorophenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK549610
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 8- fluoro- N- methyl- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1cc(CCN(c2ncnc3c2[nH]c2c3cc(cc2)F)C)ccc1OC

STK549612
Synonyms: 2- amino- N- (2- methylpropyl)- 1- [3- (trifluoromethyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(F)(F)F)C

STK549614
Synonyms: N- {(Z)- (4- fluorophenyl)[(phenylsulfonyl)imino]methyl}glycine
Smiles: OC(=O)CN/C(=N\S(=O)(=O)c1ccccc1)/c1ccc(cc1)F

STK549615
Synonyms: 5- ethyl- 10,10- dimethyl- 3- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SC/C=C/c1ccccc1)nn2)CC(OC3)(C)C

STK549616
Synonyms: 3- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (3- nitrophenyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]phenyl4- nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Oc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N

STK549617
Synonyms: 2- (4- butoxyphenyl)- 6,6- dimethyl- 4- [(2- phenylethyl)sulfanyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCCc2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK549619
Synonyms: 11- benzyl- 3- (2- methoxyphenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK549620
Synonyms: 2- {[(4- bromophenyl)sulfonyl]amino}- 1- hexyl- N- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCn1c(NS(=O)(=O)c2ccc(cc2)Br)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK549621
Synonyms: methyl2- [(7- hexyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]propanoate
Smiles: CCCCCCn1c(SC(C(=O)OC)C)nc2c1c(=O)[nH]c(=O)n2C

STK549622
Synonyms: furan- 2- yl[5- phenyl- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: O=C(N1N=C(CC1c1ccccc1)c1cccs1)c1ccco1

STK549623
Synonyms: 4- (4- chlorophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinolin- 8- yl2,4- dichlorobenzoate
Smiles: Clc1ccc(cc1)C1Nc2ccc(cc2C2C1CC=C2)OC(=O)c1ccc(cc1Cl)Cl

STK549624
Synonyms: 2- {(2Z)- 2- [3,5- bis(4- methylphenyl)cyclohex- 2- en- 1- ylidene]hydrazinyl}- 4- phenylquinazoline
Smiles: Cc1ccc(cc1)C1C/C(=N/Nc2nc3ccccc3c(n2)c2ccccc2)/C=C(C1)c1ccc(cc1)C

STK549625
Synonyms: 1- (2- chlorophenoxy)- 3- (2- methyl- 1H- imidazol- 1- yl)propan- 2- ol
Smiles: OC(Cn1ccnc1C)COc1ccccc1Cl

STK549626
Synonyms: 2- [(E)- 2- (1,3- benzodioxol- 5- yl)ethenyl]- 6- iodo- 3- (3- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1cccc(c1)n1c(/C=C/c2ccc3c(c2)OCO3)nc2c(c1=O)cc(cc2)I

STK549627
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (3- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1cccc(c1)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549628
Synonyms: 4- fluoro- N- ({2- [(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]hydrazinyl}carbonothioyl)benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)F)NNC(=O)c1c(C)onc1c1ccccc1

STK549629
Synonyms: 3- (4- chlorophenyl)- 5- [(2,5- dimethylbenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SCc2cc(C)ccc2C)nnc1c1ccc(cc1)Cl

STK549630
Synonyms: [4- (2,4- dichlorophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinolin- 8- yl](2- methylpiperidin- 1- yl)methanone
Smiles: Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC=C2)C(=O)N1CCCCC1C

STK549632
Synonyms: 6- ethyl- 6- methyl- 12- pentyl- 9- (pentylsulfanyl)- 6,12- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCCCCSc1nnc2n1c(=O)c1c(n2CCCCC)c2ccccc2CC1(C)CC

STK549634
Synonyms: N- (4- acetylphenyl)- 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK549636
Synonyms: (3aR,6aS)- 5- (3- bromophenyl)- 3- (3- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1cccc(c1)[N+](=O)[O-]

STK549637
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549638
Synonyms: 4- chloro- N- {3- [4- (3- chlorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)Cl

STK549639
Synonyms: 4- chloro- N- [3- cyano- 1- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]benzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)Cl)n(c2c1nc1ccccc1n2)c1ccccc1OC

STK549642
Synonyms: 2- [(E)- 2- (2- methylphenyl)ethenyl]- 3- (naphthalen- 1- yl)quinazolin- 4(3H)- one
Smiles: Cc1ccccc1/C=C/c1nc2ccccc2c(=O)n1c1cccc2c1cccc2

STK549644
Synonyms: 5- ethyl- 5- methyl- 3- (2- phenylethyl)- 2- (propylsulfanyl)- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CCCSc1nc2c3ccccc3CC(c2c(=O)n1CCc1ccccc1)(C)CC

STK549645
Synonyms: (6aS,6bR,9aS,10R)- 8- (2- fluorophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1F)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK549646
Synonyms: 11- benzyl- 2- ethyl- 3- (tetrahydrofuran- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCc1nc2n(Cc3ccccc3)c3c(c2c(=O)n1CC1CCCO1)nc1c(n3)cccc1

STK549647
Synonyms: 4- {[(1'S,2'S,3R,3a'R)- 2- oxo- 2'- (pyridin- 2- ylcarbonyl)- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 1'- yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccccn1)C(=O)Nc1c2cccc1

STK549648
Synonyms: (4bR,7aS,8R)- 6- (2- methoxy- 5- nitrophenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2C=CC=N1)C(=O)c1ccccc1)[N+](=O)[O-]

STK549650
Synonyms: 3- (2- methoxybenzyl)- 11- (4- methoxybenzyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)Cn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1OC

STK549651
Synonyms: 2- {[2- hydroxy- 3- (2- methylphenoxy)propyl]carbamoyl}benzoicacid
Smiles: OC(CNC(=O)c1ccccc1C(=O)O)COc1ccccc1C

STK549652
Synonyms: 8- bromo- 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)Br

STK549653
Synonyms: N- (2- ethoxyphenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK549654
Synonyms: 9- (2- methylphenyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: Cc1ccccc1n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK549655
Synonyms: 6- chloro- N- (4- methoxyphenyl)pyridazin- 3- amine
Smiles: COc1ccc(cc1)Nc1ccc(nn1)Cl

STK549656
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: CCn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549657
Synonyms: 4- {4- [4- (butan- 2- yl)phenoxy]- 6- methyl- 5- nitropyrimidin- 2- yl}morpholine
Smiles: CCC(c1ccc(cc1)Oc1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1)C

STK549658
Synonyms: 3- [(4- chlorobenzyl)sulfanyl]- 5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)Cl)nn2)CC(OC3)C(C)C

STK549661
Synonyms: (5Z)- 3- (2- chlorophenyl)- 5- (2,3- dimethoxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1c(cccc1OC)/C=C/1\SC(=S)N(C1=O)c1ccccc1Cl

STK549662
Synonyms: 11- (2- methoxyphenyl)- 10- methyl- N,8- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccccc1)c1ccccc1

STK549663
Synonyms: N- (3- chloro- 4- methylphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)C)nnc1c1cccnc1

STK549665
Synonyms: 2,4- dichloro- N- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NN1C(=S)S/C(=C\c2cccc(c2)F)/C1=O

STK549667
Synonyms: 2- amino- 1- [(4- hexylphenyl)sulfanyl]anthracene- 9,10- dione
Smiles: CCCCCCc1ccc(cc1)Sc1c(N)ccc2c1C(=O)c1ccccc1C2=O

STK549670
Synonyms: 2- methoxyethylcyano{3- [4- (diphenylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}acetate
Smiles: COCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C#N

STK549673
Synonyms: 3,3,3- trifluoro- 2- hydroxy- 2- (1H- indol- 3- yl)- 1- (piperidin- 1- yl)propan- 1- one
Smiles: O=C(C(C(F)(F)F)(c1c[nH]c2c1cccc2)O)N1CCCCC1

STK549674
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)NCCc1ccccc1

STK549675
Synonyms: N- benzyl- 2- [(2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl)sulfanyl]acetamide
Smiles: O=C(NCc1ccccc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK549678
Synonyms: 1- (4- bromophenyl)- 2- {[6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}ethanone
Smiles: CSc1nc(SCC(=O)c2ccc(cc2)Br)c2c(n1)sc1c2CC(OC1)(C)C

STK549679
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 9- fluoro- 7- hydroxy- 3- methyl- 5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: COc1cc(CCNC(=O)c2c(O)c3cc(F)cc4c3n(c2=O)C(C)CC4)ccc1OC

STK549680
Synonyms: 2- (4- chlorophenyl)- 5- (2- methylphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: Clc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC2c1ccccc1C

STK549681
Synonyms: ethyl4- {2- [(E)- 2- (2- fluorophenyl)ethenyl]- 6- iodo- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccccc2F)nc2c(c1=O)cc(cc2)I

STK549683
Synonyms: 4- [(2,6- dichlorobenzyl)sulfanyl]- 6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(SCc3c(Cl)cccc3Cl)nc(nc1s2)SC

STK549684
Synonyms: (5Z)- 5- [(1- {3- [4- (butan- 2- yl)phenoxy]propyl}- 1H- indol- 3- yl)methylidene]- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)OCCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1)C

STK549685
Synonyms: (5E)- 1- tert- butyl- 5- {3- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methoxybenzylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C/1\C(=O)NC(=O)N(C1=O)C(C)(C)C

STK549686
Synonyms: 3- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]- 8- nitro- 2H- chromen- 2- one
Smiles: Clc1ccc(c(c1)Cl)c1csc(n1)c1cc2cccc(c2oc1=O)[N+](=O)[O-]

STK549688
Synonyms: 4- ({(E)- 2- cyano- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)- N- (1,3- thiazol- 2- yl)benzenesulfonamide
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)/C#N

STK549689
Synonyms: (5Z)- 1- (4- ethylphenyl)- 5- ({1- [3- (2- methylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccccc2C)/C1=O

STK549690
Synonyms: 2- (4- chlorophenyl)- 3- [6- (2,4- dichlorophenoxy)hexyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccc(cc1Cl)Cl

STK549691
Synonyms: 2- {[8,8- dimethyl- 11- (morpholin- 4- yl)- 7,10- dihydro- 8H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1)CC

STK549694
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2- methyl- 4- nitrophenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2)[N+](=O)[O-]

STK549695
Synonyms: N~4~- (4- chlorophenyl)- N~2~,N~2~- dimethyl- 5- nitropyrimidine- 2,4,6- triamine
Smiles: Clc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(C)C

STK549696
Synonyms: N- [(1E)- 1- (3,4- diethoxyphenyl)- 3- (methylamino)- 3- oxoprop- 1- en- 2- yl]benzamide
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)NC)/NC(=O)c1ccccc1

STK549697
Synonyms: 4- (benzyloxy)- N- {(5Z)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzamide
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1

STK549699
Synonyms: N,4- dibutyl- N- methyl- 2,3,5a,10b- tetrahydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3N(CCCC)C

STK549700
Synonyms: N~4~- (2- fluorophenyl)- N~2~- (2- methoxyethyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: COCCNc1nc(Nc2ccccc2F)c(c(n1)N)[N+](=O)[O-]

STK549701
Synonyms: N- [5- (3- methyl- 4- oxo- 3,4- dihydrophthalazin- 1- yl)- 2- (morpholin- 4- yl)phenyl]- 2- (1- oxo- 4- phenylphthalazin- 2(1H)- yl)acetamide
Smiles: O=C(Cn1nc(c2ccccc2)c2c(c1=O)cccc2)Nc1cc(ccc1N1CCOCC1)c1nn(C)c(=O)c2c1cccc2

STK549702
Synonyms: N,N- dimethyl- N'- (8- methyl- 5H- pyrimido[5,4- b]indol- 4- yl)ethane- 1,2- diamine
Smiles: CN(CCNc1ncnc2c1[nH]c1c2cc(cc1)C)C

STK549703
Synonyms: 3- benzyl- 2- [(2,4- dichlorobenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Clc1ccc(c(c1)Cl)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3

STK549705
Synonyms: ethyl5,6- dimethoxy- 3- [(3- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}propanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)C/C=C/c1ccccc1)cc(c(c2)OC)OC

STK549706
Synonyms: (2E)- 3- {[2- (difluoromethoxy)phenyl]amino}- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(c(c1)OC)OC

STK549707
Synonyms: 3- (2- chlorophenyl)- 6- iodo- 2- [(E)- 2- (5- nitrofuran- 2- yl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(o1)[N+](=O)[O-])c1ccccc1Cl

STK549708
Synonyms: 1- (3,5- dimethylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c2nc3ccccc3nc2n(c1N)c1cc(C)cc(c1)C

STK549709
Synonyms: 2- {5- [(Z)- {4,6- dioxo- 1- [4- (propan- 2- yl)phenyl]- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene}methyl]- 2- methoxybenzyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)C(C)C

STK549710
Synonyms: (2E)- 3- (4- methoxyphenyl)- N- [(2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]prop- 2- enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK549711
Synonyms: 2- hydrazinyl- 3- (4- methylphenyl)quinoxaline
Smiles: NNc1nc2ccccc2nc1c1ccc(cc1)C

STK549712
Synonyms: 3- chloro- N- (2- {(2E)- 2- [1- (furan- 2- yl)ethylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: O=C(N/N=C(/c1ccco1)\C)CNC(=O)c1cccc(c1)Cl

STK549713
Synonyms: 4- {6- [(4- chlorophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}- 2- methoxyphenol
Smiles: COc1cc(ccc1O)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Cl)c1ccccc1

STK549714
Synonyms: 1- (4- {3- sulfanyl- 5- [3- (thiophen- 2- yl)- 1H- pyrazol- 5- yl]- 4H- 1,2,4- triazol- 4- yl}phenyl)ethanone
Smiles: CC(=O)c1ccc(cc1)n1c(S)nnc1c1[nH]nc(c1)c1cccs1

STK549715
Synonyms: (5E)- 1- (2- ethylphenyl)- 5- [(1- methyl- 1H- indol- 3- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cn(c3c2cccc3)C)/C1=O

STK549717
Synonyms: (4Z)- 4- [(2E)- 3- (4- nitrophenyl)prop- 2- en- 1- ylidene]- 2- (thiophen- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\C=C\c1ccc(cc1)[N+](=O)[O-])c1cccs1

STK549718
Synonyms: 2- [(4- fluorobenzyl)sulfanyl]- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: Fc1ccc(cc1)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK549720
Synonyms: 2- [(4- amino- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)Nc1ccc(cc1)C

STK549722
Synonyms: N- [(4E)- 6- (1,3- benzodioxol- 5- yl)- 8- ethoxy- 1,3- dimethyl- 4H- cyclohepta[c]furan- 4- ylidene]- N'- phenylbenzene- 1,4- diamine
Smiles: CCOc1cc(c/c(=N\c2ccc(cc2)Nc2ccccc2)/c2c1c(C)oc2C)c1ccc2c(c1)OCO2

STK549723
Synonyms: N- [(1E)- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 1- (4- methylphenyl)- 3- oxoprop- 1- en- 2- yl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)/C=C(\C(=O)NCCc1c[nH]c2c1cccc2)/NC(=O)c1ccc(cc1)C

STK549724
Synonyms: 12- (2- methylbenzyl)- 9- [(2- methylbenzyl)sulfanyl]- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclopentan]- 7(12H)- one
Smiles: Cc1ccccc1CSc1nnc2n1c(=O)c1c(n2Cc2ccccc2C)c2ccccc2CC21CCCC2

STK549725
Synonyms: 2- amino- 1- (3,4- dichlorophenyl)- N- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK549726
Synonyms: 3- (benzylsulfanyl)- 10- butyl- 7,8,9,11a- tetrahydro- 6bH- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SCc1ccccc1

STK549727
Synonyms: 3- (2- methylpropyl)- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCCC3)C

STK549728
Synonyms: 2- [4- (4- chlorophenyl)- 1- oxophthalazin- 2(1H)- yl]- N- [5- (3- methyl- 4- oxo- 3,4- dihydrophthalazin- 1- yl)- 2- (morpholin- 4- yl)phenyl]acetamide
Smiles: O=C(Cn1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)Nc1cc(ccc1N1CCOCC1)c1nn(C)c(=O)c2c1cccc2

STK549729
Synonyms: N'- [(1E)- 1- (3,4- dimethoxyphenyl)ethylidene]- 2- (1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)acetohydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)/C

STK549732
Synonyms: N'- [(1Z)- 1- (biphenyl- 4- yl)ethylidene]- 2- ({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C(\c1ccc(cc1)c1ccccc1)/C

STK549733
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- (3- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549734
Synonyms: 6- iodo- 3- (2- methyl- 5- nitrophenyl)- 2- [(E)- 2- (pyridin- 3- yl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccnc1)c1cc(ccc1C)[N+](=O)[O-]

STK549735
Synonyms: 2- bromo- N- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: S=C1S/C(=C\c2cccs2)/C(=O)N1NC(=O)c1ccccc1Br

STK549736
Synonyms: 1- (dimethylamino)- 3- (2,4,6- trichlorophenoxy)propan- 2- ol
Smiles: OC(CN(C)C)COc1c(Cl)cc(cc1Cl)Cl

STK549737
Synonyms: 8- [(4- chlorobenzyl)sulfanyl]- 5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1ccc(cc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK549739
Synonyms: 11- (1,3- benzodioxol- 5- ylmethyl)- 2- methyl- 3- pentyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK549741
Synonyms: N- (4- fluorophenyl)- 2- (pyridin- 2- yl)quinazolin- 4- amine
Smiles: Fc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccccn1

STK549744
Synonyms: 2- {4- [(5- chloro- 2- methoxyphenyl)amino]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1ccc(cc1Nc1nc(nc2c1cccc2)c1cccc(c1O)OC)Cl

STK549745
Synonyms: 2- [(3- ethyl- 6- iodo- 4- oxo- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N- (3- methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)cc(cc2)I

STK549746
Synonyms: 4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (phenoxymethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 2,6- dimethoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OC(=O)C)OC

STK549747
Synonyms: N- (2- methoxyphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK549749
Synonyms: 2- (methoxycarbonyl)phenyl1- chloro- 4- (4- chlorophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Cl)Sc1ccccc1[N+](=O)[O-]

STK549751
Synonyms: (2'R,3'R)- 3'- [(4- methoxyphenyl)carbonyl]- 2'- phenyl- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)cccc3

STK549752
Synonyms: N- (2,4- dichlorophenyl)- 2- {[2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)Nc1ccc(cc1Cl)Cl)C

STK549754
Synonyms: (5Z)- 5- ({1- [2- (3,5- dimethylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2cc(C)cc(c2)C)/C1=O

STK549755
Synonyms: N- (2,5- dichlorophenyl)- N- [3- (dimethylamino)- 2- hydroxypropyl]- 4- methylbenzenesulfonamide
Smiles: CN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1cc(Cl)ccc1Cl)O)C

STK549756
Synonyms: 9- (2- methoxyphenyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: COc1ccccc1n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK549757
Synonyms: (2E)- 2- [(5E)- 5- (3- bromo- 4- hydroxy- 5- methoxybenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- N- (3- chlorophenyl)- 2- cyanoethanamide
Smiles: COc1cc(cc(c1O)Br)/C=c\1/s/c(=C(/C(=O)Nc2cccc(c2)Cl)\C#N)/n(c1=O)c1ccccc1

STK549758
Synonyms: 4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: S=C1S/C(=C\c2cccs2)/C(=O)N1c1ccc(cc1)C(=O)O

STK549759
Synonyms: 3- amino- 1,1- bis(butylsulfanyl)- 4,7- dihydro- 1H- 4,7- ethanoisoindole- 3a,7a- dicarbonitrile
Smiles: CCCCSC1(SCCCC)N=C(C2(C1(C#N)C1CCC2C=C1)C#N)N

STK549760
Synonyms: propan- 2- yl2- amino- 1- (3- chloro- 4- fluorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F)C

STK549761
Synonyms: {1- chloro- 4- (3- nitrophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinolin- 8- yl}(2- methylpiperidin- 1- yl)methanone
Smiles: ClC1C(CC2C1c1cc(ccc1NC2c1cccc(c1)[N+](=O)[O-])C(=O)N1CCCCC1C)Sc1ccccc1[N+](=O)[O-]

STK549762
Synonyms: ethyl4- {[(2Z)- 2- cyano- 2- (4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)/C(=C/1\SCC(=O)N1c1ccccc1)/C#N

STK549763
Synonyms: 7,7- dimethyl- 1- [2- (morpholin- 4- yl)ethyl]- 2- phenyl- 1,5,7,8- tetrahydro- 4H- pyrano[4,3- d]pyrimidine- 4- thione
Smiles: S=c1nc(c2ccccc2)n(c2c1COC(C2)(C)C)CCN1CCOCC1

STK549765
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- ({1- [2- (2- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccccc2C)/C1=O)C

STK549766
Synonyms: 5- amino- 1,2- diphenyl- 1,2- dihydro- 3H- pyrrole- 3,3,4- tricarbonitrile
Smiles: N#CC1=C(N)N(C(C1(C#N)C#N)c1ccccc1)c1ccccc1

STK549767
Synonyms: 2- {[5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc4c1cccc4)nn2)CCCC3

STK549768
Synonyms: methyl4- {10- methyl- 6- [(3- methylphenyl)amino]- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)C)nc1c2cccc1

STK549769
Synonyms: ethyl(8- cyclohexyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetate
Smiles: CCOC(=O)CN1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1

STK549770
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SCC(=O)N2CCCCC2)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK549772
Synonyms: 4- (4- benzylpiperidin- 1- yl)- 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 6- methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCC(CC1)Cc1ccccc1)c1ccc(c(c1)OC)OC

STK549775
Synonyms: tert- butyl(2'R,3'R)- 2'- (3,4- dimethoxyphenyl)- 1,3- dioxo- 1,2',3,3'- tetrahydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 3'- carboxylate
Smiles: COc1ccc(cc1OC)[C@H]1[C@H](C(=O)OC(C)(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK549777
Synonyms: (4bR,7aS,8R)- 6- (4- bromophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br

STK549778
Synonyms: N- {4- [(2,6- dimethoxypyrimidin- 4- yl)sulfamoyl]phenyl}- 2- {[5- (4- methoxyphenyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(o1)SCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cc(OC)nc(n1)OC

STK549779
Synonyms: (4bR,7aS,8R)- 6- (4- chlorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Cl

STK549780
Synonyms: 4- {6- [(4- ethoxyphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}- 2- methoxyphenol
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)OC)O)c(nn1c1ccccc1)C

STK549781
Synonyms: 2- {[2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- N- methyl- N- phenylacetamide
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)N(c2ccccc2)C)c2c(n1)sc1c2CC(OC1)(C)C

STK549782
Synonyms: 2- (ethylsulfanyl)- 3- (furan- 2- ylmethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549783
Synonyms: 8- bromo- 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]c1c2cc(cc1)Br

STK549784
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- ({1- [2- (4- chlorophenoxy)ethyl]- 1H- pyrrol- 2- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cccn2CCOc2ccc(cc2)Cl)/C1=O)C

STK549787
Synonyms: N- (2- methoxy- 5- methylphenyl)- 2- {[3- (4- methylphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)C)C

STK549788
Synonyms: (4aR,4bS,7aR,8S)- 6- (2- chloro- 5- nitrophenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C([C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1Cl)[N+](=O)[O-])c1ccccc1

STK549790
Synonyms: 2- amino- 1- (4- fluorobenzyl)- N- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)F)C

STK549794
Synonyms: 1- amino- N- (2,4- dichlorophenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: Clc1ccc(c(c1)Cl)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK549795
Synonyms: 2- {[6- iodo- 4- oxo- 3- (prop- 2- en- 1- yl)- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: C=CCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)cc(cc2)I

STK549798
Synonyms: 4- amino- N- (3- chloropyrazin- 2- yl)benzenesulfonamide
Smiles: Clc1nccnc1NS(=O)(=O)c1ccc(cc1)N

STK549799
Synonyms: 2- amino- 1- [2- (4- methoxyphenyl)ethyl]- N- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)CCc1ccc(cc1)OC

STK549801
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549802
Synonyms: 3- (furan- 2- ylmethyl)- 2- (hexylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549803
Synonyms: N- [2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]propanamide
Smiles: CCC(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2

STK549805
Synonyms: N- (2,4- dichlorophenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccc(cc2Cl)Cl)c2c(n1)cccc2)C

STK549806
Synonyms: ethyl2- {[({5- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetyl]amino}- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: C=CCn1c(SCC(=O)Nc2nc(c(s2)C(=O)OCC)C)nnc1CSc1nc2c(s1)cccc2

STK549807
Synonyms: N- (4- chlorophenyl)- 11- (3- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Cl)c1ccccc1

STK549808
Synonyms: N- [2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]butanamide
Smiles: CCCC(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2

STK549809
Synonyms: (5Z)- 2- [(2,3- dimethylphenyl)amino]- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2cccc(c2C)C)cc(c1OC)OC

STK549810
Synonyms: 3- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 7,8- dimethoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cc2c(cc1OC)[nH]c1c2[nH]c(=O)n(c1=O)/N=C/c1ccc(cc1Cl)Cl

STK549811
Synonyms: 2- {[2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}- 1- (pyrrolidin- 1- yl)ethanone
Smiles: O=C(N1CCCC1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK549813
Synonyms: 1- [(1R,2S,3R)- 2- (4- bromophenyl)- 1- nitro- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl]- 2,2- dimethylpropan- 1- one
Smiles: [O-][N+](=O)[C@@H]1[C@@H](c2ccc(cc2)Br)[C@@H](N2C1c1ccccc1C=N2)C(=O)C(C)(C)C

STK549814
Synonyms: ethyl3- {[3- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cccc2

STK549818
Synonyms: methyl(2E)- (2- phenylhydrazinylidene)[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethanoate
Smiles: COC(=O)/C(=N\Nc1ccccc1)/Sc1nnnn1c1ccccc1

STK549820
Synonyms: 2- {1- [4- (2- methylpropyl)phenyl]ethyl}- 1- (naphthalen- 2- ylmethyl)- 1H- benzimidazole
Smiles: CC(Cc1ccc(cc1)C(c1nc2c(n1Cc1ccc3c(c1)cccc3)cccc2)C)C

STK549821
Synonyms: ethyl3- {[3- (4- phenylpiperazin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cccc2

STK549824
Synonyms: 3- {2- amino- 3- [(propan- 2- yloxy)carbonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}benzoicacid
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)O)C

STK549826
Synonyms: 2- amino- N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 1- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCC1=CCCCC1)C

STK549827
Synonyms: (2'R,3'R)- 3'- (2,2- dimethylpropanoyl)- 2,2- dimethyl- 2'- (4- nitrophenyl)- 2',3'- dihydro- 10b'H- spiro[1,3- dioxane- 5,1'- pyrrolo[2,1- a]phthalazine]- 4,6- dione
Smiles: O=C(C(C)(C)C)[C@@H]1N2N=Cc3c(C2C2([C@H]1c1ccc(cc1)[N+](=O)[O-])C(=O)OC(OC2=O)(C)C)cccc3

STK549828
Synonyms: 2- amino- 1- (4- fluorobenzyl)- N- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)F

STK549829
Synonyms: (6aR,6bS,9aR,10S)- 8- (2,4- dimethylphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK549832
Synonyms: 2- methoxy- 4- {10- methyl- 6- [(3- methylphenyl)amino]- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}phenol
Smiles: COc1cc(ccc1O)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C)c1ccccc1

STK549835
Synonyms: 2- methoxyethyl[3- (azepan- 1- yl)quinoxalin- 2- yl](cyano)acetate
Smiles: COCCOC(=O)C(c1nc2ccccc2nc1N1CCCCCC1)C#N

STK549838
Synonyms: 2- [(4- fluorobenzyl)sulfanyl]- 3- (3- methylphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCc1ccc(cc1)F)C

STK549839
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- anthracen- 9- ylmethylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1c2ccccc2cc2c1cccc2

STK549840
Synonyms: 2- (3- bromophenyl)- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: Brc1cccc(c1)c1nc2n(n1)cnc1c2C2(CCCCC2)Cc2c1cccc2

STK549841
Synonyms: 3- (2- phenylethyl)- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)C

STK549843
Synonyms: 2- (2- fluorophenyl)- 4- [(2E)- 2- (2- methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1F

STK549847
Synonyms: 2- [(4- chlorophenoxy)methyl]- 1- (naphthalen- 2- ylmethyl)- 1H- benzimidazole
Smiles: Clc1ccc(cc1)OCc1nc2c(n1Cc1ccc3c(c1)cccc3)cccc2

STK549850
Synonyms: 1- chloro- N,N- diethyl- 4- (4- nitrophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline- 8- carboxamide
Smiles: CCN(C(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)[N+](=O)[O-])Sc1ccccc1[N+](=O)[O-])CC

STK549851
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- ethyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK549852
Synonyms: methyl2- {[(2- ethoxy- 2- oxoethyl)carbamoyl]amino}benzoate
Smiles: CCOC(=O)CNC(=O)Nc1ccccc1C(=O)OC

STK549855
Synonyms: (2'R,3'R)- 2'- (3,4- dimethoxyphenyl)- 3'- (2,2- dimethylpropanoyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1OC)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)C(=O)C(C)(C)C

STK549856
Synonyms: N- benzyl- 1- (2- hydroxyethyl)- 2- imino- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCc1ccccc1

STK549857
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCC3

STK549858
Synonyms: 1- amino- N- (4- bromophenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK549860
Synonyms: 2- {2- [(4- butyl- 2,3,5a,10b- tetrahydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCCN1C(=O)c2c(C1=O)cccc2

STK549861
Synonyms: 2- (4- {(1E)- 1- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]ethyl}- 2- methoxyphenoxy)acetamide
Smiles: COc1cc(ccc1OCC(=O)N)/C(=N/NC(=O)c1nnn(c1CN1CCC(CC1)C)c1nonc1N)/C

STK549862
Synonyms: propan- 2- ylcyano{3- [4- (diphenylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C(=O)OC(C)C

STK549863
Synonyms: 11- (3,5- dimethylphenyl)- 2- ethyl- 3- (1- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCc1nc2n(c3cc(C)cc(c3)C)c3c(c2c(=O)n1C(c1ccccc1)C)nc1c(n3)cccc1

STK549865
Synonyms: 7- benzyl- 8- {[2- (dimethylamino)ethyl]amino}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(CCNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C)C

STK549867
Synonyms: N- (3- methylphenyl)- 2- (4- methylpiperazin- 1- yl)- 5- nitropyrimidine- 4,6- diamine
Smiles: CN1CCN(CC1)c1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK549869
Synonyms: (2,2- diphenylcyclopropyl)(morpholin- 4- yl)methanone
Smiles: O=C(C1CC1(c1ccccc1)c1ccccc1)N1CCOCC1

STK549870
Synonyms: 4- (benzyloxy)- N- {(5Z)- 5- [4- (octyloxy)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzamide
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1

STK549872
Synonyms: 2- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SC/C=C/c1ccccc1

STK549875
Synonyms: ethyl4- {6- iodo- 4- oxo- 2- [(E)- 2- phenylethenyl]quinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccccc2)nc2c(c1=O)cc(cc2)I

STK549876
Synonyms: 2- methoxy- 4- [3- (piperidin- 1- yl)prop- 1- yn- 1- yl]phenol
Smiles: COc1cc(C#CCN2CCCCC2)ccc1O

STK549877
Synonyms: N'- [(3Z)- 5- bromo- 2- oxo- 1- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- (2,3- dimethylphenoxy)acetohydrazide
Smiles: O=C(COc1cccc(c1C)C)N/N=C/1\C(=O)N(c2c1cc(Br)cc2)CN1CCCCC1c1cccnc1

STK549879
Synonyms: 3- {2,4- dioxo- 5- [2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: O=C(CC1SC(=O)N(C1=O)CCC(=O)O)Nc1nccs1

STK549882
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK549883
Synonyms: 2- {[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK549884
Synonyms: 2- [(E)- 2- (2- hydroxyphenyl)ethenyl]- 6- iodo- 3- (naphthalen- 1- yl)quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1O)c1cccc2c1cccc2

STK549886
Synonyms: 2,7- bis[(dipropylamino)methyl]- 1,8- bis(4- propoxyphenyl)octane- 1,8- dione
Smiles: CCCN(CC(C(=O)c1ccc(cc1)OCCC)CCCCC(C(=O)c1ccc(cc1)OCCC)CN(CCC)CCC)CCC

STK549887
Synonyms: ethyl3- {[2- (3,5- dimethylpiperidin- 1- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CC(C)CC(C1)C)C)cc(c(c2)OC)OC

STK549890
Synonyms: 3- (2,3- dimethoxyphenyl)- 2,5- diphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: COc1c(OC)cccc1C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1ccccc1

STK549891
Synonyms: 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- N- phenylacetamide
Smiles: CSc1nc(SCC(=O)Nc2ccccc2)c2c(n1)sc1c2CCCC1

STK549892
Synonyms: (4bR,7aS,8R)- 6- (2,4- dimethylphenyl)- 8- (phenylcarbonyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)C1N([C@H]2C(=O)c2ccccc2)N=CC=C1

STK549893
Synonyms: 3- [(2- chlorobenzyl)sulfanyl]- 5- hydrazinyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: NNc1nc2sc3c(c2c2n1c(SCc1ccccc1Cl)nn2)CC(OC3)(C)C

STK549894
Synonyms: N- [2- (ethylamino)ethyl]- 9- fluoro- 7- hydroxy- 3- methyl- 5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: CCNCCNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)C(C)CC3

STK549895
Synonyms: N- (2- methoxyphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK549896
Synonyms: 8- [(2- chlorobenzyl)sulfanyl]- 5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1ccccc1CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK549898
Synonyms: N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 8- methyl- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)NCCC1=CCCCC1

STK549899
Synonyms: 5- [5- (4- methoxyphenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)CCCC(=O)O)c1cccs1

STK549900
Synonyms: 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 6- methoxy- 4- (4- phenylpiperazin- 1- yl)quinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1ccccc1)c1ccc(c(c1)OC)OC

STK549901
Synonyms: 3- (4- bromophenyl)- 7- (naphthalen- 2- yl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Brc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc2c(c1)cccc2

STK549903
Synonyms: 2- [(E)- 2- (4- hydroxyphenyl)ethenyl]- 3- (2- phenylethyl)quinazolin- 4(3H)- one
Smiles: Oc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1CCc1ccccc1

STK549905
Synonyms: ethyl7- [({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}acetyl)amino]- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc1c(c2)OCO1

STK549906
Synonyms: N- (diphenylmethyl)- 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549907
Synonyms: N- (3- chloro- 4- methylphenyl)- 11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccco1)n1c(=N2)c(Nc2ccc(c(c2)Cl)C)nc2c1cccc2)c1ccccc1

STK549909
Synonyms: 2- (2- fluorophenyl)- 4- {(2Z)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1ccc(cc1)/C(=N\Nc1nc(nc2c1cccc2)c1ccccc1F)/C

STK549910
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCC3)CCC

STK549911
Synonyms: ethyl7- ({[4- (ethoxycarbonyl)piperazin- 1- yl]acetyl}amino)- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc1OCOc1c2)C(=O)OCC

STK549912
Synonyms: 2- [(3- methylbutyl)sulfanyl]- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(CCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)C

STK549914
Synonyms: (5Z)- 3- (2- chlorophenyl)- 5- (4- ethoxy- 3- methoxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)c1ccccc1Cl

STK549915
Synonyms: 6- iodo- 3- (naphthalen- 1- yl)- 2- {(E)- 2- [4- (propan- 2- yl)phenyl]ethenyl}quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)C(C)C)c1cccc2c1cccc2

STK549917
Synonyms: N- (4- chlorophenyl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1

STK549918
Synonyms: 2- amino- N- (1,3- benzodioxol- 5- ylmethyl)- 1- (4- fluorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Fc1ccc(cc1)Cn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccc2c(c1)OCO2

STK549920
Synonyms: N~6~- (2,3- dichlorophenyl)- N~4~- ethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: CCNc1cc(Nc2cccc(c2Cl)Cl)c(c2c1non2)[N+](=O)[O-]

STK549921
Synonyms: 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK549922
Synonyms: 2- ethyl- 11- (4- methoxybenzyl)- 3- (1- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)Cn1c2nc(CC)n(c(=O)c2c2c1nc1ccccc1n2)C(c1ccccc1)C

STK549923
Synonyms: ethyl5- bromo- 3- ({3- [4- (2,3- dimethylphenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1C)C)cc(cc2)Br

STK549925
Synonyms: ethyl7- ({[4- (ethoxycarbonyl)piperidin- 1- yl]acetyl}amino)- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc1OCOc1c2)C(=O)OCC

STK549926
Synonyms: 1- butyl- 2- (4- ethylphenyl)- 5,6- diphenyl- 1H- imidazo[1,2- a]imidazole
Smiles: CCCCn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccc(cc1)CC

STK549927
Synonyms: (9E)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 9- (4- methoxybenzylidene)- 5- (4- methoxyphenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccc(cc1)OC)/CN(C2)C

STK549928
Synonyms: 11- (3,5- dimethylphenyl)- 2- methyl- 3- (1- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cc(C)cc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)C(c1ccccc1)C

STK549932
Synonyms: N- {(1E)- 1- (3,4- diethoxyphenyl)- 3- [(4- methylphenyl)amino]- 3- oxoprop- 1- en- 2- yl}- 4- methoxybenzamide
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)Nc1ccc(cc1)C)/NC(=O)c1ccc(cc1)OC

STK549933
Synonyms: 4- phenyl- 2H- [1,3,5]triazino[2,1- b][1,3]benzothiazole- 2- thione
Smiles: S=c1nc2sc3c(n2c(n1)c1ccccc1)cccc3

STK549934
Synonyms: 2- (ethoxycarbonyl)phenyl1- chloro- 4- (4- nitrophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: CCOC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)[N+](=O)[O-])Sc1ccccc1[N+](=O)[O-]

STK549935
Synonyms: 2- [(4- bromobenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 6,6- dimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK549937
Synonyms: 2- (4- chlorophenyl)- 3- [5- (2,4- dichlorophenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1Cl)Cl

STK549938
Synonyms: (5E)- 1- (2,4- dimethylphenyl)- 5- (furan- 2- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O

STK549939
Synonyms: (6aR,6bS,9aR,10S)- 8- (2,5- dimethoxyphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: COc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-])OC

STK549940
Synonyms: (5Z)- 1- (3- chloro- 4- methoxyphenyl)- 5- {[1- (2- methylbenzyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2C)/C1=O

STK549941
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK549942
Synonyms: 2- {[6- iodo- 3- (2- methylphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK549943
Synonyms: 4- chloro- N- {1- (3,5- dimethylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc(cc2)Cl)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK549945
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549946
Synonyms: 2- chloro- N- (4- methoxyphenyl)- 5- nitropyrimidine- 4,6- diamine
Smiles: COc1ccc(cc1)Nc1nc(Cl)nc(c1[N+](=O)[O-])N

STK549947
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (4- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C)C

STK549948
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- phenyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK549949
Synonyms: 3- (4- methoxyphenyl)- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549950
Synonyms: 1- [(3- octyl- 1H- 1,2,4- triazol- 5- yl)sulfanyl]propan- 2- one
Smiles: CCCCCCCCc1n[nH]c(n1)SCC(=O)C

STK549951
Synonyms: (5E)- 1- (3- chloro- 4- methylphenyl)- 5- [4- (dimethylamino)- 3- nitrobenzylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc(c(c1)[N+](=O)[O-])N(C)C)c1ccc(c(c1)Cl)C

STK549952
Synonyms: 2- chloro- 3- [3- (3,4- dimethoxyphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 5- yl]- 7- methoxyquinoline
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1S(=O)(=O)C)c1ccc(c(c1)OC)OC)Cl

STK549954
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3,4- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C)C

STK549955
Synonyms: 7,8- dimethoxy- 3- {[(1E,2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cc2c(cc1OC)[nH]c1c2[nH]c(=O)n(c1=O)/N=C/C(=C/c1ccccc1)/C

STK549956
Synonyms: N- (4- chlorophenyl)- 2- {[5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK549957
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: CCn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK549958
Synonyms: (4- methoxyphenyl)[(1R,2S,3R)- 2- (4- methoxyphenyl)- 1- nitro- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl]methanone
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@H](c2ccc(cc2)OC)[C@H](C2N1N=Cc1c2cccc1)[N+](=O)[O-]

STK549960
Synonyms: N~2~,N~4~- bis(2- fluorophenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: Fc1ccccc1Nc1nc(N)c(c(n1)Nc1ccccc1F)[N+](=O)[O-]

STK549961
Synonyms: 2- [(4- amino- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)NC(CCc1ccccc1)C

STK549963
Synonyms: 1- (1H- benzimidazol- 2- ylmethoxy)- 3- (1- benzofuran- 2- yl)quinoxalin- 2(1H)- one4- oxide
Smiles: [O-][n+]1c(c2cc3c(o2)cccc3)c(=O)n(c2c1cccc2)OCc1nc2c([nH]1)cccc2

STK549964
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK549965
Synonyms: N- [2- (morpholin- 4- yl)ethyl]- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CC(c1nc2sc3c(c2c2c1CCC2)ncnc3NCCN1CCOCC1)C

STK549966
Synonyms: 4- [(8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C

STK549968
Synonyms: 2,2- difluoro- 2- (2,3,3,4,4,5,5- heptafluorotetrahydrofuran- 2- yl)- N- [3- (pyrrolidin- 1- ylsulfonyl)phenyl]acetamide
Smiles: O=C(C(C1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F)Nc1cccc(c1)S(=O)(=O)N1CCCC1

STK549969
Synonyms: 11- (4- ethoxyphenyl)- 10- methyl- N,8- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccccc1)nc1c2cccc1

STK549973
Synonyms: 4- {6- [(2- ethoxyphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}- 2- methoxyphenol
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)OC)O)C)c1ccccc1

STK549974
Synonyms: 8- [(3- methoxypropyl)amino]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCCNc1[nH]c2c(n1)n(C)c(=O)[nH]c2=O

STK549975
Synonyms: 5- (morpholin- 4- yl)- 9- (pyridin- 2- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: O=c1c2sc3c(c2ncn1c1ccccn1)c1CCCCc1c(n3)N1CCOCC1

STK549977
Synonyms: 1- amino- N- (3,4- dichlorophenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)Nc1ccc(c(c1)Cl)Cl

STK549979
Synonyms: 4- bromo- 2- {6- [(4- chlorophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}phenol
Smiles: Brc1ccc(c(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Cl)c1ccccc1)O

STK549980
Synonyms: 2- {[6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: CCC1(C)OCc2c(C1)c1c(SCC(=O)NCCc3ccccc3)nc(nc1s2)SC

STK549981
Synonyms: 5- [3- chloro- 4- (propan- 2- yloxy)benzyl]- 4- phenyl- 4H- 1,2,4- triazole- 3- thiol
Smiles: CC(Oc1ccc(cc1Cl)Cc1nnc(n1c1ccccc1)S)C

STK549982
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (2,2- dimethylpropanoyl)- 2'- (furan- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)c1ccco1

STK549983
Synonyms: 3- [5- (2- chloro- 4- methylphenoxy)pentyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1Cl)C

STK549984
Synonyms: 3- (2,5- dimethylphenyl)- 11- (4- ethoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)ccc1C

STK549985
Synonyms: 6- chloro- N- ({4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}carbonothioyl)pyridine- 3- carboxamide
Smiles: S=C(N1CCN(CC1)C/C=C/c1ccccc1)NC(=O)c1ccc(nc1)Cl

STK549986
Synonyms: 3- [3- (2- bromo- 4,6- dimethylphenoxy)propyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Br)C

STK549987
Synonyms: tert- butyl(2'S,3'R)- 2'- (2,4- dichlorophenyl)- 1,3- dioxo- 1,2',3,3'- tetrahydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 3'- carboxylate
Smiles: Clc1ccc(c(c1)Cl)[C@H]1[C@H](C(=O)OC(C)(C)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK549988
Synonyms: 2- {[4- (4- methylphenyl)- 5- oxo- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- (1- phenylpropan- 2- yl)acetamide
Smiles: O=C(NC(Cc1ccccc1)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCCC3

STK549989
Synonyms: 4- {(E)- [2- ({[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}acetyl)hydrazinylidene]methyl}- 2,6- dimethoxyphenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(s2)SCc2ccccc2)cc(c1OC(=O)C)OC

STK549990
Synonyms: 2- [(4- tert- butylphenoxy)methyl]- 1- (4- phenoxybutyl)- 1H- benzimidazole
Smiles: CC(c1ccc(cc1)OCc1nc2c(n1CCCCOc1ccccc1)cccc2)(C)C

STK549991
Synonyms: 2- {[2- (3,4- dimethoxyphenyl)- 2- oxoethyl]sulfanyl}- 3- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(c(c2)OC)OC)nc2c(c1=O)cccc2

STK549992
Synonyms: (5Z)- 5- {[1- (4- chlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- (3- chloro- 4- methylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK549993
Synonyms: 1- amino- N- (2- methylphenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)Nc1ccccc1C

STK549994
Synonyms: 4- {6- [(4- butylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C

STK549995
Synonyms: 8- methoxy- 2- methyl- 3- {[(E)- (4- nitrophenyl)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)[N+](=O)[O-]

STK549996
Synonyms: 5- cyano- N- (2- fluorophenyl)- 4- (furan- 2- yl)- 6- {[2- (4- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)OC)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1F)C

STK549997
Synonyms: 2- [(3- ethyl- 6- iodo- 4- oxo- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2ccc(cc2c(=O)n1CC)I)CCC

STK549998
Synonyms: ethylthieno[2,3- b]quinoline- 2- carboxylate
Smiles: CCOC(=O)c1cc2c(s1)nc1c(c2)cccc1

STK550001
Synonyms: (4aS,4bR,7aS,8R)- 8- [(3- nitrophenyl)carbonyl]- 6- [3- (trifluoromethyl)phenyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@H]2[C@@H]1[C@@H]1C=CC=NN1[C@H]2C(=O)c1cccc(c1)[N+](=O)[O-]

STK550002
Synonyms: N- (2- iodophenyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1ccc(co1)C(=O)Nc1ccccc1I

STK550003
Synonyms: 11- (3- bromophenyl)- 10- methyl- N,8- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccccc1)c1ccccc1

STK550005
Synonyms: ethyl5- bromo- 3- {[3- (4- carbamoylpiperidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)C(=O)N)cc(cc2)Br

STK550007
Synonyms: (8R,8aS,11aR)- 10- (2- chlorophenyl)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK550008
Synonyms: ethyl4- {2- [(E)- 2- (4- chlorophenyl)ethenyl]- 6- iodo- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(cc2)Cl)nc2c(c1=O)cc(cc2)I

STK550009
Synonyms: N- carbamoyl- 4- {[(E)- 2- cyano- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}ethenyl]amino}benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1ccc(cc1)CC(C)C

STK550010
Synonyms: N- (4- acetylphenyl)- 2- [(5- oxo- 4- phenyl- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3

STK550011
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK550012
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 11- (3,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cc(C)cc(c1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)Cc1ccc2c(c1)OCO2

STK550013
Synonyms: 1- [2- (3,4- dimethoxyphenyl)ethyl]- 3- [(4- fluorophenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: COc1cc(ccc1OC)CCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)F

STK550015
Synonyms: 1- methoxypropan- 2- yl1- (3- acetylphenyl)- 2- amino- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(=O)C)C

STK550016
Synonyms: 7,8- dimethoxy- 3- ({(E)- [4- methoxy- 3- (pyrrolidin- 1- ylmethyl)phenyl]methylidene}amino)- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1CN1CCCC1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(c(c1)OC)OC

STK550020
Synonyms: (5Z)- 1- (2,5- dimethoxyphenyl)- 5- {3- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methoxybenzylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(c(c1)N1C(=O)NC(=O)/C(=C/c2ccc(c(c2)CN2C(=O)c3c(C2=O)cccc3)OC)/C1=O)OC

STK550021
Synonyms: ethyl5- bromo- 3- ({3- [4- (ethoxycarbonyl)piperidin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CCC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OCC

STK550022
Synonyms: (4bR,7aS,8R)- 8- [(4- methoxyphenyl)carbonyl]- 6- phenyl- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1

STK550023
Synonyms: 2- [(6- iodo- 4- oxo- 3- phenyl- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)N(c1ccccc1)c1ccccc1)c1ccccc1

STK550025
Synonyms: 3- [(3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- 1- (4- fluorophenyl)pyrrolidine- 2,5- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C1=O)Cn1nc(cc1C)C

STK550026
Synonyms: 1- (3,4- dimethoxyphenyl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)ethanone
Smiles: COc1cc(ccc1OC)C(=O)CSc1nnc(s1)SCc1cccc2c1cccc2

STK550029
Synonyms: 2- (4- methoxyphenyl)- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclopentane]
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCC2

STK550030
Synonyms: (9E)- 9- (4- chlorobenzylidene)- 5- (4- chlorophenyl)- 7- methyl- 3- phenyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)Cl)/C2=C(C1)C(c1ccc(cc1)Cl)n1c(=N2)scc1c1ccccc1

STK550031
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(1Z)- 1- (2,4- dichlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(\c1ccc(cc1Cl)Cl)/C)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK550032
Synonyms: 4- (benzylsulfanyl)- 6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CSc1nc(SCc2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK550033
Synonyms: methyl1- acetyl- 7- (4- chloro- 3- fluorophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(c(c1)F)Cl)C(=O)C

STK550034
Synonyms: 3- [3- (furan- 2- yl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 5- yl]- 6- methylquinolin- 2(1H)- one
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)C1CC(=NN1S(=O)(=O)C)c1ccco1

STK550038
Synonyms: 5- (3- methoxyphenyl)- 3- (4- methoxyphenyl)- 2,3a- diphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: COc1ccc(cc1)C1N(OC2C1(c1ccccc1)C(=O)N(C2=O)c1cccc(c1)OC)c1ccccc1

STK550039
Synonyms: 4- bromo- N- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2cccc(c2)F)/C1=O

STK550042
Synonyms: 1- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 3- (2,4,6- trichlorophenoxy)propan- 2- ol
Smiles: OC(Cn1nc(cc1C)C)COc1c(Cl)cc(cc1Cl)Cl

STK550043
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 3- (3- methylphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCc1ccccc1Cl)C

STK550044
Synonyms: methyl2- {[(2- methoxyphenyl)carbonyl]amino}- 4- methyl- 5- phenylthiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)c2ccccc2OC)sc(c1C)c1ccccc1

STK550045
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCc1cccc(c1)F

STK550046
Synonyms: 3- (4- methoxyphenyl)- 5- (4- methylphenyl)- 2,3a- diphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: COc1ccc(cc1)C1N(OC2C1(c1ccccc1)C(=O)N(C2=O)c1ccc(cc1)C)c1ccccc1

STK550047
Synonyms: 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C/C=C/c1ccccc1)c([nH]2)C

STK550048
Synonyms: 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: CC(=C)Cn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550049
Synonyms: 5- (4- ethylphenyl)- 3- (4- hydroxy- 3- methoxyphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(c(c1)OC)O)c1ccccc1

STK550050
Synonyms: 3- iodo- N- [2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]benzamide
Smiles: Ic1cccc(c1)C(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2

STK550051
Synonyms: 1- amino- N- (3- methylphenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK550054
Synonyms: (2E)- 3- {[2- (difluoromethoxy)phenyl]amino}- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1C)C

STK550055
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550057
Synonyms: N- (3- methoxyphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK550058
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- [2- (trifluoromethyl)phenyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C1[C@@H]2[C@H](C(=O)N1c1ccccc1C(F)(F)F)[C@@H]1N([C@@H]2C(=O)C(C)(C)C)C=Cc2c1cccc2

STK550059
Synonyms: (2'R,3'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- (4- nitrophenyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccc(cc1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3

STK550064
Synonyms: (2'R,3'R)- 2'- (4- methoxyphenyl)- 3'- [(4- methoxyphenyl)carbonyl]- 2,2- dimethyl- 2',3'- dihydro- 10b'H- spiro[1,3- dioxane- 5,1'- pyrrolo[2,1- a]phthalazine]- 4,6- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2C2([C@H]1c1ccc(cc1)OC)C(=O)OC(OC2=O)(C)C)cccc3

STK550065
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 6,6- dimethyl- 3- phenyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Clc1ccc(c(c1)Cl)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK550067
Synonyms: 6- ethyl- 6- methyl- 12- propyl- 9- (propylsulfanyl)- 6,12- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCCSc1nnc2n1c(=O)c1c(n2CCC)c2ccccc2CC1(C)CC

STK550073
Synonyms: 5- (2- acetyl- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 3- butyl- 6- hydroxy- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: CCCCn1c(=S)[nH]c(c(c1=O)C1N(CCc2c1cccc2)C(=O)C)O

STK550076
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (2,3- dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C/c1cccc(c1Cl)Cl

STK550077
Synonyms: (5Z)- 1- (3- chloro- 4- methoxyphenyl)- 5- ({1- [2- (4- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(cc2)C)/C1=O

STK550079
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCc2cccc(c2)F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK550080
Synonyms: 2,4- dichloro- N- [(2- methoxydibenzo[b,d]furan- 3- yl)carbamothioyl]benzamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)c1ccc(cc1Cl)Cl)oc1c2cccc1

STK550081
Synonyms: (4aS,4bR,7aS,8R)- 6- (2- methoxy- 5- nitrophenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)c2cccc(c2)[N+](=O)[O-])N=CC=C1)[N+](=O)[O-]

STK550083
Synonyms: N- (4- acetylphenyl)- 2- {[3- (4- methoxyphenyl)- 6,6- dimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)C)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK550084
Synonyms: 1- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n2c1nnc2SCc1c(Cl)cccc1Cl

STK550085
Synonyms: 2- [(5- oxo- 4- phenyl- 4,5,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC3

STK550086
Synonyms: 4- {6- [(4- chlorophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: Clc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)O)O)C)c1ccccc1

STK550087
Synonyms: (5Z)- 1- (4- ethylphenyl)- 5- ({1- [3- (3- methylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2cccc(c2)C)/C1=O

STK550089
Synonyms: N- (4- bromophenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1)Br)nc1c2cccc1

STK550090
Synonyms: (2'R,3'R)- 2'- (2,3- dimethoxyphenyl)- 3'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cccc(c1OC)OC)C(=O)c1c(C2=O)cccc1)cccc3

STK550092
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- (4- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK550095
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK550096
Synonyms: 3- chloro- N- (2- formyl- 6,6- dimethylbicyclo[3.1.1]hept- 2- en- 3- yl)- 1- benzothiophene- 2- carboxamide
Smiles: O=CC1=C(NC(=O)c2sc3c(c2Cl)cccc3)CC2CC1C2(C)C

STK550097
Synonyms: 3- (3- nitrophenyl)- 7- phenyl- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: O=C1CC2(C(=O)N1c1ccccc1)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK550098
Synonyms: N- (4- bromophenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK550099
Synonyms: 5- [3- (6- bromo- 2- oxo- 4- phenyl- 1,2- dihydroquinolin- 3- yl)- 5- (4- fluorophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccc(cc1)F)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

STK550101
Synonyms: 2- (diethylamino)ethyl4- ({(Z)- 2- cyano- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1cc2ccccc2oc1=O)/C#N)CC

STK550102
Synonyms: (5Z)- 5- ({1- [2- (4- chloro- 3- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(c(c2)C)Cl)/C1=O

STK550103
Synonyms: ethyl6- (4- methoxyphenyl)- 2- oxo- 4- phenylcyclohex- 3- ene- 1- carboxylate
Smiles: CCOC(=O)C1C(=O)C=C(CC1c1ccc(cc1)OC)c1ccccc1

STK550106
Synonyms: 1- (4- chlorophenyl)- 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}ethanone
Smiles: CSc1nc(SCC(=O)c2ccc(cc2)Cl)c2c(n1)sc1c2CCCC1

STK550107
Synonyms: (5Z)- 5- {[1- (3,4- dichlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(c(c2)Cl)Cl)/C1=O

STK550109
Synonyms: (4bR,7aS,8R)- 6- (3- fluorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)F

STK550110
Synonyms: 1- [(2- chlorobenzyl)sulfanyl]- 4- phenyl- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccccc1CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC3

STK550111
Synonyms: [3- (6- chloro- 2- methyl- 4- phenylquinolin- 3- yl)- 5- (2- chlorophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl](phenyl)methanone
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)C)C1=NN(C(C1)c1ccccc1Cl)C(=O)c1ccccc1

STK550112
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- methyl- 5- nitrophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@H]1N2c3ccccc3C=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])Nc1ccc(cc1)[N+](=O)[O-]

STK550114
Synonyms: 2- [(E)- 2- (3- nitrophenyl)ethenyl]- 3- (2- phenylethyl)quinazolin- 4(3H)- one
Smiles: [O-][N+](=O)c1cccc(c1)/C=C/c1nc2ccccc2c(=O)n1CCc1ccccc1

STK550115
Synonyms: ethyl1- acetyl- 7- (4- ethoxyphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOc1ccc(cc1)N1C(=O)CC2(C1=O)CC(=NN2C(=O)C)C(=O)OCC

STK550116
Synonyms: 8- [(2,6- dichlorobenzyl)sulfanyl]- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1cccc(c1CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)Cl

STK550117
Synonyms: N,N- diethyl- N'- [11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]benzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccco2)c(nn1c1ccccc1)C)CC

STK550120
Synonyms: 3- (4- chlorophenyl)- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Clc1ccc(cc1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK550121
Synonyms: 3- (2,6- dichlorophenyl)- 2- [(E)- 2- (3- methylphenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Cc1cccc(c1)/C=C/c1nc2ccccc2c(=O)n1c1c(Cl)cccc1Cl

STK550122
Synonyms: ethyl5,6- dimethoxy- 3- ({3- [4- (2- methoxyphenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1OC)cc(c(c2)OC)OC

STK550123
Synonyms: ethyl5,6- dimethoxy- 3- ({[4- (pyridin- 2- yl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccn1)cc(c(c2)OC)OC

STK550124
Synonyms: 9- fluoro- 7- hydroxy- 3- methyl- 5- oxo- N- [3- (piperidin- 1- yl)propyl]- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: Fc1cc2CCC(n3c2c(c1)c(O)c(c3=O)C(=O)NCCCN1CCCCC1)C

STK550125
Synonyms: 10,10- dimethyl- 5- (methylsulfanyl)- 3- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SC/C=C/c1ccccc1)nn2)CC(OC3)(C)C

STK550126
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (phenoxymethyl)- N'- [(1Z)- 1- phenylethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: C/C(=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N)/c1ccccc1

STK550128
Synonyms: 3- butyl- 2- (propylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCCC)CCCC3

STK550129
Synonyms: 3- {3- [(2- chloronaphthalen- 1- yl)oxy]propyl}- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(Cl)ccc2c1cccc2

STK550131
Synonyms: N- (4- iodophenyl)- 7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCN(CC1)c1cc(Nc2ccc(cc2)I)c(c2c1non2)[N+](=O)[O-]

STK550133
Synonyms: 5- [(4- methoxy- 3- nitrobenzyl)sulfanyl]- 2- methyl- 4- nitro- 1H- imidazole
Smiles: COc1ccc(cc1[N+](=O)[O-])CSc1[nH]c(nc1[N+](=O)[O-])C

STK550134
Synonyms: (2E)- N- (2- {(2Z)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 2- oxoethyl)- 3- phenylprop- 2- enamide(non- preferredname)
Smiles: O=C(N/N=C(\c1ccc(cc1)Cl)/C)CNC(=O)/C=C/c1ccccc1

STK550135
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CC(=C)Cn1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550137
Synonyms: 1,1'- methanediylbis{3- [3- (dipropylamino)- 2- hydroxypropyl]- 5,5- dimethylimidazolidine- 2,4- dione}
Smiles: CCCN(CC(CN1C(=O)N(C(C1=O)(C)C)CN1C(=O)N(C(=O)C1(C)C)CC(CN(CCC)CCC)O)O)CCC

STK550139
Synonyms: propan- 2- yl2- amino- 1- (2,3- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1C)C)C

STK550140
Synonyms: 2- [(10- butyl- 7,8,9,11a- tetrahydro- 6bH- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- N- (2,4- dichlorophenyl)acetamide
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SCC(=O)Nc1ccc(cc1Cl)Cl

STK550141
Synonyms: 1- (4- chlorophenyl)- 2- {[6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}ethanone
Smiles: CSc1nc(SCC(=O)c2ccc(cc2)Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK550142
Synonyms: (2E)- N- [(9,10- dioxo- 9,10- dihydroanthracen- 2- yl)carbamothioyl]- 3- (4- methoxyphenyl)prop- 2- enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)NC(=S)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1

STK550143
Synonyms: 3- bromo- N- (naphthalen- 1- yl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)Nc1cccc2c1cccc2

STK550144
Synonyms: N- [(Z)- {[(4- chlorophenyl)sulfonyl]imino}(4- fluorophenyl)methyl]glycine
Smiles: OC(=O)CN/C(=N\S(=O)(=O)c1ccc(cc1)Cl)/c1ccc(cc1)F

STK550145
Synonyms: 1- (2- methylphenyl)- 3- {5- [(4- propylphenoxy)methyl]- 1,3,4- thiadiazol- 2- yl}urea
Smiles: CCCc1ccc(cc1)OCc1nnc(s1)NC(=O)Nc1ccccc1C

STK550146
Synonyms: N- carbamoyl- 4- ({(Z)- 2- cyano- 2- [4- (2,4- dimethylphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C/Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1ccc(cc1C)C

STK550149
Synonyms: 1- [(4- chlorobenzyl)sulfanyl]- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CC(OCc3sc2n2c1nnc2SCc1ccc(cc1)Cl)C(C)C

STK550150
Synonyms: ethyl3- ethyl- 3- methyl- 1- [(phenylacetyl)amino]- 3,4- dihydronaphthalene- 2- carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)Cc2ccccc2)c2ccccc2CC1(C)CC

STK550154
Synonyms: 2- (heptylsulfanyl)- 6- iodo- 3- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCCCCCCSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)OC)I

STK550155
Synonyms: 4- {2- amino- 3- [(propan- 2- yloxy)carbonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}benzoicacid
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)O)C

STK550156
Synonyms: 2- (8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetohydrazide
Smiles: NNC(=O)CN1CCn2c3C1CCCc3c1c2ccc(c1)C

STK550157
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (3,4- dimethoxyphenyl)ethanone
Smiles: COc1cc(ccc1OC)C(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK550158
Synonyms: methyl2- {[(3- methoxynaphthalen- 2- yl)carbonyl]amino}- 4,5- dimethylthiophene- 3- carboxylate
Smiles: COc1cc2ccccc2cc1C(=O)Nc1sc(c(c1C(=O)OC)C)C

STK550159
Synonyms: (2E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 3- [(5- methoxy- 2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)Cl

STK550160
Synonyms: 2- [(3- methylbenzyl)sulfanyl]- 3- (prop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C=CCn1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550161
Synonyms: 2- {(2Z)- 2- [(2E)- (4- chlorobenzylidene)hydrazinylidene]- 4- oxo- 1,3- thiazolidin- 5- yl}- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(CC1S/C(=N\N=C\c2ccc(cc2)Cl)/NC1=O)Nc1cccc(c1)C(F)(F)F

STK550162
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- ({1- [2- (4- methoxyphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK550163
Synonyms: pentyl[(2- ethyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetate
Smiles: CCCCCOC(=O)CSc1nc(CC)nc2c1c1CC(C)(C)OCc1s2

STK550164
Synonyms: ethyl1- {3- [1- cyano- 2- oxo- 2- (prop- 2- en- 1- yloxy)ethyl]quinoxalin- 2- yl}piperidine- 4- carboxylate
Smiles: C=CCOC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C(=O)OCC)C#N

STK550165
Synonyms: ethyl3- ({3- [4- (3- chlorophenyl)piperazin- 1- yl]propanoyl}amino)- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)Cl)cc(c(c2)OC)OC

STK550166
Synonyms: methyl(2E)- {(2Z)- 2- [1- cyano- 2- oxo- 2- (phenylamino)ethylidene]- 4- oxo- 3- phenyl- 1,3- thiazolidin- 5- ylidene}ethanoate
Smiles: N#C/C(=c\1/s/c(=C/C(=O)OC)/c(=O)n1c1ccccc1)/C(=O)Nc1ccccc1

STK550167
Synonyms: prop- 2- en- 1- yl2- amino- 1- (2,3- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1C)C

STK550168
Synonyms: 1- (2- bromoprop- 2- en- 1- yl)- 2- ethyl- 1H- benzimidazole
Smiles: CCc1nc2c(n1CC(=C)Br)cccc2

STK550169
Synonyms: N- (diphenylmethyl)- 2- [(2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl)sulfanyl]acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK550170
Synonyms: 2- {[4- (4- methylphenyl)- 5- oxo- 4,5,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

STK550171
Synonyms: N- [4- (acetylamino)phenyl]- 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK550172
Synonyms: ethyl2- ({(Z)- 2- cyano- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cc3ccccc3oc2=O)/C#N)sc2c1CCCC2

STK550173
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {5- chloro- 2- [(2- chloro- 6- fluorobenzyl)oxy]phenyl}methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)OCc1c(F)cccc1Cl

STK550174
Synonyms: 7- {[2- (4- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CC1CCN(CC1)CCNc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK550175
Synonyms: 4- {3- [4- (dimethylamino)phenyl]- 4,6- dioxo- 2- phenylhexahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl}benzoicacid
Smiles: CN(c1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(cc1)C(=O)O)C

STK550176
Synonyms: (2E)- 3- (4- bromophenyl)- N- {[2- (pyridin- 3- yl)piperidin- 1- yl]carbamothioyl}prop- 2- enamide
Smiles: S=C(NN1CCCCC1c1cccnc1)NC(=O)/C=C/c1ccc(cc1)Br

STK550183
Synonyms: methyl{(4E)- 4- [(2E)- (5- {2- [(4- bromophenyl)amino]- 2- oxoethyl}- 4- oxo- 1,3- thiazolidin- 2- ylidene)hydrazinylidene]- 2- oxo- 1,3- thiazolidin- 5- yl}acetate
Smiles: COC(=O)CC1SC(=O)N/C/1=N/N=C/1\NC(=O)C(S1)CC(=O)Nc1ccc(cc1)Br

STK550185
Synonyms: (5E)- 5- [4- (dimethylamino)benzylidene]- 1- (2,5- dimethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccc(cc2)N(C)C)/C1=O)C

STK550186
Synonyms: 6,6- dimethyl- 3- (4- methylphenyl)- 2- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK550187
Synonyms: N'- [2- (methylsulfanyl)- 6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CSc1nc(NNC(=O)c2ccccc2)c2c(n1)sc1c2CCC1

STK550188
Synonyms: (9E)- 9- (4- chlorobenzylidene)- 5- (4- chlorophenyl)- 7- methyl- 3- (4- methylphenyl)- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)Cl)/C2=C(C1)C(c1ccc(cc1)Cl)n1c(=N2)scc1c1ccc(cc1)C

STK550189
Synonyms: (5Z)- 3- (2- fluorophenyl)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccccc1F

STK550192
Synonyms: N- (4- acetylphenyl)- 2- {[4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1ncnc2c1sc1c2c2CCCc2c(n1)C(C)C

STK550194
Synonyms: 4- (2- methoxyphenyl)- 3- methyl- 2,6- bis(4- methylphenyl)piperidin- 4- ol
Smiles: COc1ccccc1C1(O)CC(NC(C1C)c1ccc(cc1)C)c1ccc(cc1)C

STK550195
Synonyms: ethyl4- {6- iodo- 2- [(E)- 2- (5- nitrofuran- 2- yl)ethenyl]- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(o2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK550196
Synonyms: 1- methoxypropan- 2- ylcyano{3- [4- (diphenylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C#N)C

STK550198
Synonyms: 2- amino- N- butyl- 1- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK550199
Synonyms: 2- [(naphthalen- 2- ylmethyl)sulfanyl]- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCc1ccc2c(c1)cccc2

STK550201
Synonyms: (2Z)- 2- [(5Z)- 5- {[5- (3- chloro- 4- nitrophenyl)furan- 2- yl]methylidene}- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyano- N- (furan- 2- ylmethyl)ethanamide
Smiles: N#C/C(=c\1/s/c(=C\c2ccc(o2)c2ccc(c(c2)Cl)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)NCc1ccco1

STK550203
Synonyms: 8- [(4- bromobenzyl)sulfanyl]- 5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Brc1ccc(cc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK550205
Synonyms: 6- ethyl- 6- methyl- 12- (propan- 2- yl)- 9- (propan- 2- ylsulfanyl)- 6,12- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n1c(n2C(C)C)nnc1SC(C)C

STK550206
Synonyms: (5Z)- 2- [(4- fluorophenyl)amino]- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2ccc(cc2)F)cc(c1OC)OC

STK550207
Synonyms: ethyl4- {[(2E,5Z)- 5- (2- chloro- 4,5- dimethoxybenzylidene)- 3- methyl- 4- oxo- 1,3- thiazolidin- 2- ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2cc(OC)c(cc2Cl)OC)/C(=O)N1C

STK550208
Synonyms: 2- {(2Z)- 2- [(2E)- (4- chlorobenzylidene)hydrazinylidene]- 4- oxo- 1,3- thiazolidin- 5- yl}- N- (3- chlorophenyl)acetamide
Smiles: O=C(CC1S/C(=N\N=C\c2ccc(cc2)Cl)/NC1=O)Nc1cccc(c1)Cl

STK550209
Synonyms: 2- (4- butoxyphenyl)- 6,6- dimethyl- 4- [(naphthalen- 2- ylmethyl)sulfanyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2ccc3c(c2)cccc3)c2c(n1)sc1c2CC(OC1)(C)C

STK550210
Synonyms: 1- phenyl- 1H- tetrazol- 5- yl(1E)- N- (2- chlorophenyl)- 2- oxopropanehydrazonothioate
Smiles: CC(=O)/C(=N\Nc1ccccc1Cl)/Sc1nnnn1c1ccccc1

STK550211
Synonyms: 2- amino- 1- [4- (morpholin- 4- yl)phenyl]- N- octyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)N1CCOCC1

STK550212
Synonyms: 2- [(E)- 2- (4- bromophenyl)ethenyl]- 3- (2,5- dibromophenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1cc(Br)ccc1Br

STK550213
Synonyms: 3- [(naphthalen- 2- ylmethyl)sulfanyl]- 6,8,9,10- tetrahydro- 5H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 5- one
Smiles: O=c1[nH]c2sc3c(c2c2n1c(SCc1ccc4c(c1)cccc4)nn2)CCC3

STK550217
Synonyms: 3- methyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cn1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK550218
Synonyms: 4- bromo- 2- (6- {[4- (diethylamino)phenyl]amino}- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl)phenol
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cc(Br)ccc1O)C)c1ccccc1)CC

STK550219
Synonyms: 1- amino- 5- (morpholin- 4- yl)- N- (pyridin- 2- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)Nc1ccccn1

STK550220
Synonyms: 2- [(5Z)- 5- (2- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]pentanoicacid
Smiles: CCCC(N1C(=S)S/C(=C\c2ccccc2OC)/C1=O)C(=O)O

STK550221
Synonyms: (6aR,6bS,9aR,10S)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@@H]1[C@@H]2C(=O)NC(=O)[C@@H]2[C@@H]2N1c1ccccc1C=C2)Nc1ccc(cc1)[N+](=O)[O-]

STK550222
Synonyms: 4- [5- (furan- 2- yl)- 3- (4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)CCC(=O)O

STK550224
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (3- nitrophenyl)- N'- [(E)- (2,4,6- trimethylphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1cc(C)c(c(c1)C)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N

STK550226
Synonyms: (5Z)- 1- (4- ethylphenyl)- 5- {[1- (naphthalen- 1- ylmethyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2cccc3c2cccc3)/C1=O

STK550227
Synonyms: 2- amino- 1- hexyl- N- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cccc(c1)C

STK550228
Synonyms: ethyl4- {2- [(E)- 2- (4- bromophenyl)ethenyl]- 6- iodo- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(cc2)Br)nc2c(c1=O)cc(cc2)I

STK550229
Synonyms: 2- {[7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}phenol
Smiles: CC1CCN(CC1)c1cc(Nc2ccccc2O)c(c2c1non2)[N+](=O)[O-]

STK550231
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- (prop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C=CCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550232
Synonyms: (2E,5Z)- 2- [(2- methylphenyl)imino]- 5- (thiophen- 2- ylmethylidene)- 1,3- thiazolidin- 4- one
Smiles: O=C1N/C(=N\c2ccccc2C)/S/C/1=C\c1cccs1

STK550233
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[1- (naphthalen- 1- ylmethyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2cccc3c2cccc3)/C1=O)C

STK550235
Synonyms: 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 3- ethyl- 6- iodoquinazolin- 4(3H)- one
Smiles: CCn1c(SC/C=C(/Cl)\C)nc2c(c1=O)cc(cc2)I

STK550236
Synonyms: 3- (butylsulfanyl)- 5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK550238
Synonyms: N'- [(1E)- 1- (4- hydroxyphenyl)propylidene]thiophene- 2- carbohydrazide
Smiles: CC/C(=N\NC(=O)c1cccs1)/c1ccc(cc1)O

STK550239
Synonyms: azepan- 1- yl[2- (4- methoxyphenyl)- 6- methylquinolin- 4- yl]methanone
Smiles: COc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)N1CCCCCC1)C

STK550240
Synonyms: 3- (4- methoxyphenyl)- 2- (pentylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCC3

STK550242
Synonyms: 1- [5- (2- chloro- 7- methoxyquinolin- 3- yl)- 3- (3,4- dimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]propan- 1- one
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)CC)c1ccc(c(c1)OC)OC)Cl

STK550243
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[1- (2,4- dichlorobenzyl)- 1H- pyrrol- 2- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cccn2Cc2ccc(cc2Cl)Cl)/C1=O)C

STK550244
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc2c(c1)OCO2

STK550245
Synonyms: methyl2- {[(3- bromo- 2- oxo- 2H- pyran- 5- yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)c1coc(=O)c(c1)Br

STK550246
Synonyms: 2- (2- {[6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CCC1(C)OCc2c(C1)c1c(SCCN3C(=O)c4c(C3=O)cccc4)nc(nc1s2)SC

STK550247
Synonyms: 6- chloro- N- (4- nitrophenyl)- 4- phenylquinolin- 2- amine
Smiles: Clc1ccc2c(c1)c(cc(n2)Nc1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK550249
Synonyms: 3- [(4- chlorobenzyl)sulfanyl]- 5- (2- chlorophenyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccc(cc1)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK550250
Synonyms: 4- [4- (dimethylamino)phenyl]- 6- (furan- 2- yl)- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(=O)[nH]c(cc1c1ccc(cc1)N(C)C)c1ccco1

STK550251
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550252
Synonyms: (2E)- 2- [5- (2- chlorobenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyano- N- (4- ethylphenyl)ethanamide
Smiles: CCc1ccc(cc1)NC(=O)/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccccc1Cl)/C#N

STK550253
Synonyms: 3- (2- hydroxy- 5- methylphenyl)- 3- phenyl- N- (2- phenylethyl)propanamide
Smiles: Cc1ccc(c(c1)C(c1ccccc1)CC(=O)NCCc1ccccc1)O

STK550255
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 11- (3,4- dichlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)Cl)Cl)c(nn1c1ccccc1)C

STK550256
Synonyms: 4- (3,4- dihydroquinolin- 1(2H)- yl)- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccccc1c1nc2ccccc2c(n1)N1CCCc2c1cccc2

STK550257
Synonyms: (5E)- 5- [(1- methyl- 1H- indol- 2- yl)methylidene]- 2- thioxo- 1- [3- (trifluoromethyl)phenyl]dihydropyrimidine- 4,6(1H,5H)- dione
Smiles: S=C1NC(=O)/C(=C\c2cc3c(n2C)cccc3)/C(=O)N1c1cccc(c1)C(F)(F)F

STK550258
Synonyms: 2- amino- N- hexyl- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)CCCOC

STK550259
Synonyms: 2,5,6- triphenyl- 1- propyl- 1H- imidazo[1,2- a]imidazole
Smiles: CCCn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccccc1

STK550261
Synonyms: 2- (diethylamino)ethyl4- ({(Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1cc2cc(Br)ccc2oc1=O)/C#N)CC

STK550262
Synonyms: N'- [(1Z)- 1- (4- hydroxy- 3- methoxyphenyl)ethylidene]pyridine- 4- carbohydrazide
Smiles: COc1cc(ccc1O)/C(=N\NC(=O)c1ccncc1)/C

STK550263
Synonyms: (5Z)- 1- (4- bromophenyl)- 5- ({[5- (diethylamino)pentan- 2- yl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCN(CCCC(N/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br)C)CC

STK550264
Synonyms: 3- [4- (dimethylamino)phenyl]- 5- (2,4- dimethylphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)N(C)C

STK550265
Synonyms: 6,6- dimethyl- 2- (methylsulfanyl)- 4- (prop- 2- en- 1- ylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: C=CCSc1nc(SC)nc2c1c1CC(C)(C)OCc1s2

STK550266
Synonyms: 1- (4- {[7- (dimethylamino)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}phenyl)ethanone
Smiles: [O-][N+](=O)c1c(Nc2ccc(cc2)C(=O)C)cc(c2c1non2)N(C)C

STK550268
Synonyms: N- (4- acetylphenyl)- 2- [(6,6- dimethyl- 4- oxo- 3- phenyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK550270
Synonyms: 11- (3- chlorophenyl)- 10- methyl- N- (3- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C)c1ccccc1

STK550273
Synonyms: 7- (4- fluorophenyl)- 3- (3- nitrophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Fc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK550274
Synonyms: N'- [(1E)- 1- (4- nitrophenyl)ethylidene]- 2- oxopiperidine- 3- carbohydrazide
Smiles: C/C(=N\NC(=O)C1CCCNC1=O)/c1ccc(cc1)[N+](=O)[O-]

STK550275
Synonyms: N- {3- [(3- chloro- 4- methoxyphenyl)amino]quinoxalin- 2- yl}- 4- methylbenzenesulfonamide
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)C

STK550276
Synonyms: 3- [(4- chlorobenzyl)sulfanyl]- 10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)Cl)nn2)CC(OC3)(C)C

STK550277
Synonyms: 12- butyl- 9- (butylsulfanyl)- 6- ethyl- 6- methyl- 6,12- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCCCn1c2c3ccccc3CC(c2c(=O)n2c1nnc2SCCCC)(C)CC

STK550279
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK550280
Synonyms: (2E,2'Z)- N,N'- ethane- 1,2- diylbis{2- [5- (4- chlorobenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyanoethanamide}
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)Cl)/C(=O)NCCNC(=O)/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)Cl)/C#N

STK550282
Synonyms: 6- hydroxy- 2- (octylsulfanyl)- 3- (prop- 2- en- 1- yl)- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)pyrimidin- 4(3H)- one
Smiles: C=CCn1c(SCCCCCCCC)nc(c(c1=O)C1NCCc2c1cccc2)O

STK550284
Synonyms: 1- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SCc1c(Cl)cccc1Cl

STK550285
Synonyms: N- (2- ethoxyphenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccccc1OCC)c1ccccc1

STK550286
Synonyms: 3- (2- phenylethyl)- 2- (propylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK550287
Synonyms: 12- (prop- 2- en- 1- yl)- 9- (prop- 2- en- 1- ylsulfanyl)- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclopentan]- 7(12H)- one
Smiles: C=CCn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCC=C)CCCC3

STK550288
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (phenoxymethyl)- N'- [(E)- pyridin- 2- ylmethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1COc1ccccc1)C(=O)N/N=C/c1ccccn1

STK550289
Synonyms: 4- (naphthalen- 1- yloxy)- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2cccc3c2cccc3)c2c(n1)cccc2)C

STK550291
Synonyms: 1,3- bis(2- methylphenyl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1/C(=C/NN2CCCCC2c2cccnc2)/C(=O)N(C(=S)N1c1ccccc1C)c1ccccc1C

STK550292
Synonyms: (3aR,4S,8aS,8bS)- 2- (2- methyl- 5- nitrophenyl)- 4- (phenylcarbonyl)hexahydropyrrolo[3,4- a]pyrrolizine- 1,3(2H,4H)- dione
Smiles: O=C([C@H]1N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])c1ccccc1

STK550293
Synonyms: 7- {[2- (4- benzylpiperazin- 1- yl)ethyl]amino}- 3- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)NCCN1CCN(CC1)Cc1ccccc1)c(=O)c1c(c2=O)cccc1

STK550295
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nnc1c1cccnc1

STK550296
Synonyms: N~4~- (4- methoxyphenyl)- 5- nitro- N~2~- (tetrahydrofuran- 2- ylmethyl)pyrimidine- 2,4,6- triamine
Smiles: COc1ccc(cc1)Nc1nc(NCC2CCCO2)nc(c1[N+](=O)[O-])N

STK550297
Synonyms: 2- {[10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)N(c1ccccc1)c1ccccc1)nn2)CC(OC3)(C)C

STK550298
Synonyms: 1- (3- chloro- 4- fluorophenyl)- 3- [(3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccc(c(c1)Cl)F)Cn1nc(cc1C)C

STK550299
Synonyms: 5- (2- chlorophenyl)[1,2,4]triazolo[4,3- c]quinazoline
Smiles: Clc1ccccc1c1nc2ccccc2c2n1cnn2

STK550300
Synonyms: ethyl4- {[11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(cc1)C(=O)OCC)nc1c2cccc1

STK550301
Synonyms: (5Z)- 5- {[5- (4- bromophenyl)furan- 2- yl]methylidene}- 1- (3- chloro- 4- methoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2)Br)/C1=O

STK550303
Synonyms: 2- (ethylsulfanyl)- 3- (2- methylpropyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK550304
Synonyms: ethyl4- {2- [(E)- 2- (5- bromo- 2- hydroxyphenyl)ethenyl]- 6- iodo- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2cc(Br)ccc2O)nc2c(c1=O)cc(cc2)I

STK550305
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (3- methylphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCc1ccc(cc1Cl)Cl)C

STK550306
Synonyms: 2- (4- {4- [(4- chlorophenyl)amino]phthalazin- 1- yl}phenoxy)- 1- (piperidin- 1- yl)ethanone
Smiles: Clc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(cc1)OCC(=O)N1CCCCC1

STK550308
Synonyms: 2- (2- {[2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CCCCOc1ccc(cc1)c1nc(SCCN2C(=O)c3c(C2=O)cccc3)c2c(n1)sc1c2CC(OC1)(C)C

STK550309
Synonyms: ethyl3- {(E)- [4- (ethoxycarbonyl)piperidin- 1- yl]diazenyl}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)/N=N/c1c([nH]c2c1cccc2)C(=O)OCC

STK550311
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- {(E)- [4- (methylsulfanyl)phenyl]methylidene}acetohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1

STK550312
Synonyms: 2- {[3- (2- methylpropyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CC(Cn1c(SCC(=O)N)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1)C

STK550314
Synonyms: 2- (cyclohexylamino)- 1- (3,4- dihydroxyphenyl)ethanone
Smiles: O=C(c1ccc(c(c1)O)O)CNC1CCCCC1

STK550315
Synonyms: 4- [(6aS,6bR,9aS,10R)- 10- {[4- (acetyloxy)phenyl]carbonyl}- 7,9- dioxo- 6b,7,9a,10- tetrahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 8(9H)- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2[C@H]2N1c1ccccc1C=C2)c1ccc(cc1)OC(=O)C

STK550316
Synonyms: 1- [3- (2- methylphenoxy)propyl]- 2- {1- [4- (2- methylpropyl)phenyl]ethyl}- 1H- benzimidazole
Smiles: CC(Cc1ccc(cc1)C(c1nc2c(n1CCCOc1ccccc1C)cccc2)C)C

STK550317
Synonyms: 5- [4- (methylsulfanyl)phenyl]- 2- (naphthalen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CSc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccc2c(c1)cccc2

STK550320
Synonyms: ethyl3- ({3- [4- (2- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(c(c2)OC)OC

STK550322
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(s1)SCc1cccc2c1cccc2

STK550323
Synonyms: ethyl3- ({3- [4- (4- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)cc(cc2)OC

STK550324
Synonyms: ethyl1- acetyl- 7- (4- fluorophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)F)C(=O)C

STK550326
Synonyms: 3- (dec- 9- en- 1- yl)- 5- (octylsulfanyl)- 1H- 1,2,4- triazole
Smiles: CCCCCCCCSc1[nH]nc(n1)CCCCCCCCC=C

STK550328
Synonyms: 5- (2- chlorophenyl)- 3- (propylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK550329
Synonyms: 6- ethyl- 6- methyl- 7- oxo- 5,7,9,10- tetrahydro- 6H- benzo[h][1,3]thiazolo[2,3- b]quinazoline- 10- carbonitrile
Smiles: N#CC1Cn2c(S1)nc1c(c2=O)C(C)(CC)Cc2c1cccc2

STK550331
Synonyms: 4- butoxy- N'- [2- (2- chlorophenyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CCCCOc1ccc(cc1)C(=O)NNc1nc(nc2c1c1CCCCc1s2)c1ccccc1Cl

STK550333
Synonyms: 2,4- dichloro- N- [(5Z)- 4- oxo- 5- (pyridin- 3- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NN1C(=S)S/C(=C\c2cccnc2)/C1=O

STK550334
Synonyms: 3- {[(E)- (2,4- dimethoxyphenyl)methylidene]amino}- 7,8- dimethoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc(c(c1)OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(c(c1)OC)OC

STK550336
Synonyms: N- (diphenylmethyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK550337
Synonyms: (2'R,3'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- (3- nitrophenyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cccc(c1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3

STK550339
Synonyms: N,N- diethyl- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)N(CC)CC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK550340
Synonyms: dipropan- 2- yl[hydroxy(4- methylphenyl)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccc(cc1)C)O)OC(C)C)C

STK550341
Synonyms: 4- [(4aS,4bR,7aS,8R)- 8- [(3- nitrophenyl)carbonyl]- 5,7- dioxo- 4b,5,7a,8- tetrahydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazin- 6(7H)- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)c2cccc(c2)[N+](=O)[O-])N=CC=C1

STK550342
Synonyms: (8R,8aS,11aR)- 8- (2,2- dimethylpropanoyl)- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)C(C)(C)C

STK550343
Synonyms: (5E)- 1- (2,5- dimethylphenyl)- 5- (2,4,5- trimethoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cc(OC)c(cc1/C=C/1\C(=O)NC(=O)N(C1=O)c1cc(C)ccc1C)OC

STK550344
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(COC)C

STK550345
Synonyms: 2- (2- ethylpiperidin- 1- yl)- 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: CCC1CCCCN1CC(=O)c1c(C)[nH]c2c1cc(OC)cc2

STK550346
Synonyms: 6- chloro- 2- [1',3'- diphenyl- 5- (thiophen- 2- yl)- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]- 4- phenylquinazoline
Smiles: Clc1ccc2c(c1)c(nc(n2)N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1cccs1)c1ccccc1

STK550348
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCc1ccc(cc1)Cl

STK550349
Synonyms: 8- fluoro- N- [2- (4- fluorophenyl)ethyl]- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: Fc1ccc(cc1)CCNc1ncnc2c1[nH]c1c2cc(cc1)F

STK550350
Synonyms: 4- ({(E)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)- N- (1,3- thiazol- 2- yl)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)/c1scc(n1)c1ccc(cc1)Cl

STK550351
Synonyms: N,N- diethyl- N'- [11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]benzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)F)c(nn1c1ccccc1)C)CC

STK550353
Synonyms: 1- (2- chloro- 10H- phenothiazin- 10- yl)- 2- (piperidin- 1- yl)ethanone
Smiles: Clc1ccc2c(c1)N(C(=O)CN1CCCCC1)c1c(S2)cccc1

STK550354
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1cc(OC)c(c(c1)OC)OC)/C#N

STK550358
Synonyms: 2- [(1Z)- 1- {2- [2- (2- fluorophenyl)quinazolin- 4- yl]hydrazinylidene}ethyl]phenol
Smiles: Oc1ccccc1/C(=N\Nc1nc(nc2c1cccc2)c1ccccc1F)/C

STK550359
Synonyms: 3- [(4- fluorobenzyl)sulfanyl]- 5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)F)nn2)CC(OC3)C(C)C

STK550360
Synonyms: 3- imino- 1- methyl- 5- (propan- 2- yl)- 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)C(C)C)C#N

STK550361
Synonyms: methyl5- bromo- 1- [2- (4- hydroxyphenyl)ethyl]- 6- oxo- 1,6- dihydropyridine- 3- carboxylate
Smiles: COC(=O)c1cn(CCc2ccc(cc2)O)c(=O)c(c1)Br

STK550364
Synonyms: 8- bromo- 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Brc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccccc1F

STK550366
Synonyms: 1- benzyl- 2- (4- ethylphenyl)- 5,6- diphenyl- 1H- imidazo[1,2- a]imidazole
Smiles: CCc1ccc(cc1)c1cn2c(n1Cc1ccccc1)nc(c2c1ccccc1)c1ccccc1

STK550367
Synonyms: (8R,8aS,11aR)- 10- (1,3- benzodioxol- 5- yl)- 8- (2,2- dimethylpropanoyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@H]2[C@@H]1C1N([C@H]2C(=O)C(C)(C)C)N=Cc2c1cccc2

STK550369
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Clc1ccc(c(c1)Cl)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK550371
Synonyms: 5- (4- bromophenyl)- 3- (2- methoxyphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazole
Smiles: COc1ccccc1C1=NN(C(C1)c1ccc(cc1)Br)S(=O)(=O)C

MOBILEDETECT:0