Product OPENEYE NAME: 3-(3-methoxyphenyl)-1-methyl-pyrrole
CAS Name: 3-(3-methoxyphenyl)-1-methylpyrrole
IUPAC NAME: 3-(3-methoxyphenyl)-1-methylpyrrole
SYSTEMATIC NAME: 3-(3-methoxyphenyl)-1-methyl-pyrrole
MOLECULAR FORMULA: C12H13NO
MOLECULAR WEIGHT: 187.23772
SMILES: CN1C=CC(=C1)C2=CC(=CC=C2)OC
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Product OPENEYE NAME: 1-methyl-3-[3-(trifluoromethyl)phenyl]pyrrole
CAS Name: 1-methyl-3-[3-(trifluoromethyl)phenyl]pyrrole
IUPAC NAME: 1-methyl-3-[3-(trifluoromethyl)phenyl]pyrrole
SYSTEMATIC NAME: 1-methyl-3-[3-(trifluoromethyl)phenyl]pyrrole
MOLECULAR FORMULA: C12H10F3N
MOLECULAR WEIGHT: 225.20971
SMILES: CN1C=CC(=C1)C2=CC(=CC=C2)C(F)(F)F
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Product OPENEYE NAME: 1-[2-(m-tolyl)ethyl]pyrrolidine
CAS Name: 1-[2-(3-methylphenyl)ethyl]pyrrolidine
IUPAC NAME: 1-[2-(3-methylphenyl)ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-(3-methylphenyl)ethyl]pyrrolidine
MOLECULAR FORMULA: C13H19N
MOLECULAR WEIGHT: 189.29666
SMILES: CC1=CC(=CC=C1)CCN2CCCC2
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Product OPENEYE NAME: 2-[2-[2-[(2S)-2-[(5Z)-5-[(4-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoyl]oxyethoxy]ethoxy]ethyl (2S)-2-[(5Z)-5-[(4-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoate
CAS Name: (2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-phenylpropanoic acid 2-[2-[2-[(2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxo-3-phenylpropoxy]ethoxy]ethoxy]ethyl ester
IUPAC NAME: 2-[2-[2-[(2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoyl]oxyethoxy]ethoxy]ethyl (2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoate
SYSTEMATIC NAME: 2-[2-[2-[(2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoyl]oxyethoxy]ethoxy]ethyl (2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl
MOLECULAR FORMULA: C44H38Br2N2O8S4
MOLECULAR WEIGHT: 1010.84912
SMILES: C1=CC=C(C=C1)C[C@H](N2C(=S)S/C(=C\C3=CC=C(C=C3)Br)/C2=O)C(=O)OCCOCCOCCOC(=O)[C@@H](N4C(=S)S/C(=C\C5=CC=C(C=C5)Br)/C4=O)CC6=CC=CC=C6
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Product OPENEYE NAME: ethyl (2S)-2-[(5Z)-5-[[4-[[4-[(Z)-[3-[(1S)-1-benzyl-2-ethoxy-2-oxo-ethyl]-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]phenoxy]methoxy]phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoate
CAS Name: (2S)-2-[(5Z)-5-[[4-[[4-[(Z)-[3-[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]phenoxy]methoxy]phenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-phenylpropanoic acid ethyl ester
IUPAC NAME: ethyl (2S)-2-[(5Z)-5-[[4-[[4-[(Z)-[3-[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methoxy]phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoate
SYSTEMATIC NAME: ethyl (2S)-2-[(5Z)-5-[[4-[[4-[(Z)-[3-[(2S)-1-ethoxy-1-oxidanylidene-3-phenyl-propan-2-yl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methoxy]phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-p
MOLECULAR FORMULA: C43H38N2O8S4
MOLECULAR WEIGHT: 839.03042
SMILES: CCOC(=O)[C@@H](N1C(=S)S/C(=C\C2=CC=C(C=C2)OCOC3=CC=C(C=C3)/C=C/4\SC(=S)N(C4=O)[C@H](C(=O)OCC)CC5=CC=CC=C5)/C1=O)CC6=CC=CC=C6
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Product OPENEYE NAME: 6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-1-isobutyl-benzimidazole
CAS Name: 6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-1-(2-methylpropyl)benzimidazole
IUPAC NAME: 6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-1-(2-methylpropyl)benzimidazole
SYSTEMATIC NAME: 6-[2-[2,6-bis(fluoranyl)phenyl]-5-phenyl-1H-imidazol-4-yl]-1-(2-methylpropyl)benzimidazole
MOLECULAR FORMULA: C26H22F2N4
MOLECULAR WEIGHT: 428.476486
SMILES: CC(C)CN1C=NC2=C1C=C(C=C2)C3=C(NC(=N3)C4=C(C=CC=C4F)F)C5=CC=CC=C5
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Product OPENEYE NAME: 3-(3-bromophenyl)-1-methyl-pyrrole
CAS Name: 3-(3-bromophenyl)-1-methylpyrrole
IUPAC NAME: 3-(3-bromophenyl)-1-methylpyrrole
SYSTEMATIC NAME: 3-(3-bromophenyl)-1-methyl-pyrrole
MOLECULAR FORMULA: C11H10BrN
MOLECULAR WEIGHT: 236.1078
SMILES: CN1C=CC(=C1)C2=CC(=CC=C2)Br
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Product OPENEYE NAME: 6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-N-ethyl-1H-benzimidazol-2-amine
CAS Name: 6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-N-ethyl-1H-benzimidazol-2-amine
IUPAC NAME: 6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-N-ethyl-1H-benzimidazol-2-amine
SYSTEMATIC NAME: 6-[2-[2,6-bis(fluoranyl)phenyl]-5-phenyl-1H-imidazol-4-yl]-N-ethyl-1H-benzimidazol-2-amine
MOLECULAR FORMULA: C24H19F2N5
MOLECULAR WEIGHT: 415.437966
SMILES: CCNC1=NC2=C(N1)C=C(C=C2)C3=C(NC(=N3)C4=C(C=CC=C4F)F)C5=CC=CC=C5
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Product OPENEYE NAME: [(3S)-3-(hexadecanoylamino)-2-hydroxy-4-(1H-indol-3-yl)butyl]phosphonic acid
CAS Name: [(3S)-2-hydroxy-4-(1H-indol-3-yl)-3-(1-oxohexadecylamino)butyl]phosphonic acid
IUPAC NAME: [(3S)-3-(hexadecanoylamino)-2-hydroxy-4-(1H-indol-3-yl)butyl]phosphonic acid
SYSTEMATIC NAME: [(3S)-3-(hexadecanoylamino)-4-(1H-indol-3-yl)-2-oxidanyl-butyl]phosphonic acid
MOLECULAR FORMULA: C28H47N2O5P
MOLECULAR WEIGHT: 522.656941
SMILES: CCCCCCCCCCCCCCCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(CP(=O)(O)O)O
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Product OPENEYE NAME: 1-[1-[4-(2-chloro-3-thienyl)phenyl]propyl]imidazole
CAS Name: 1-[1-[4-(2-chloro-3-thiophenyl)phenyl]propyl]imidazole
IUPAC NAME: 1-[1-[4-(2-chlorothiophen-3-yl)phenyl]propyl]imidazole
SYSTEMATIC NAME: 1-[1-[4-(2-chloranylthiophen-3-yl)phenyl]propyl]imidazole
MOLECULAR FORMULA: C16H15ClN2S
MOLECULAR WEIGHT: 302.8217
SMILES: CCC(C1=CC=C(C=C1)C2=C(SC=C2)Cl)N3C=CN=C3
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Product OPENEYE NAME: [(3S)-4-(1-benzylindol-3-yl)-3-(hexadecanoylamino)-2-hydroxy-butyl]phosphonic acid
CAS Name: [(3S)-2-hydroxy-3-(1-oxohexadecylamino)-4-[1-(phenylmethyl)-3-indolyl]butyl]phosphonic acid
IUPAC NAME: [(3S)-4-(1-benzylindol-3-yl)-3-(hexadecanoylamino)-2-hydroxybutyl]phosphonic acid
SYSTEMATIC NAME: [(3S)-3-(hexadecanoylamino)-2-oxidanyl-4-[1-(phenylmethyl)indol-3-yl]butyl]phosphonic acid
MOLECULAR FORMULA: C35H53N2O5P
MOLECULAR WEIGHT: 612.779481
SMILES: CCCCCCCCCCCCCCCC(=O)N[C@@H](CC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)C(CP(=O)(O)O)O
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Product OPENEYE NAME: 3-amino-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-tetrahydropyran-4-yl-pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]propanamide
CAS Name: 3-amino-N-[(1S)-1-[2-[4-[[(3S,4R)-4-(4-chlorophenyl)-1-(4-oxanyl)-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-5-methylphenyl]-2-methylpropyl]propanamide
IUPAC NAME: 3-amino-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-(oxan-4-yl)pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methylphenyl]-2-methylpropyl]propanamide
SYSTEMATIC NAME: 3-azanyl-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-(oxan-4-yl)pyrrolidin-3-yl]carbonylpiperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]propanamide
MOLECULAR FORMULA: C34H48ClN5O3
MOLECULAR WEIGHT: 610.22962
SMILES: CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)[C@@H]3CN(C[C@H]3C4=CC=C(C=C4)Cl)C5CCOCC5)[C@H](C(C)C)NC(=O)CCN
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Product OPENEYE NAME: 2-amino-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-tetrahydropyran-4-yl-pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]acetamide
CAS Name: 2-amino-N-[(1S)-1-[2-[4-[[(3S,4R)-4-(4-chlorophenyl)-1-(4-oxanyl)-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-5-methylphenyl]-2-methylpropyl]acetamide
IUPAC NAME: 2-amino-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-(oxan-4-yl)pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methylphenyl]-2-methylpropyl]acetamide
SYSTEMATIC NAME: 2-azanyl-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-(oxan-4-yl)pyrrolidin-3-yl]carbonylpiperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]ethanamide
MOLECULAR FORMULA: C33H46ClN5O3
MOLECULAR WEIGHT: 596.20304
SMILES: CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)[C@@H]3CN(C[C@H]3C4=CC=C(C=C4)Cl)C5CCOCC5)[C@H](C(C)C)NC(=O)CN
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Product OPENEYE NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-(butanoylamino)-5-guanidino-pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-guanidino-pentanoyl]amino]-3-methyl-pentanoyl]amino]hexanamide
CAS Name: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-1-oxo-2-(1-oxobutylamino)pentyl]amino]-1-oxo-3-phenylpropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopentyl]amino]-3-methyl-1-ox
IUPAC NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-(butanoylamino)-5-(diaminomethylideneamino)pentanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]hex
SYSTEMATIC NAME: (2S)-6-azanyl-2-[[(2S,3S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-(butanoylamino)pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methyl-pentanoy
MOLECULAR FORMULA: C46H74N14O8
MOLECULAR WEIGHT: 951.16876
SMILES: CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N
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Product OPENEYE NAME: (2S)-2,6-diamino-N-[2-[[4-[2-[[(2S)-2,6-diaminohexanoyl]amino]ethylamino]-9,10-dioxo-1-anthryl]amino]ethyl]hexanamide
CAS Name: (2S)-2,6-diamino-N-[2-[[4-[2-[[(2S)-2,6-diamino-1-oxohexyl]amino]ethylamino]-9,10-dioxo-1-anthracenyl]amino]ethyl]hexanamide
IUPAC NAME: (2S)-2,6-diamino-N-[2-[[4-[2-[[(2S)-2,6-diaminohexanoyl]amino]ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethyl]hexanamide
SYSTEMATIC NAME: (2S)-2,6-bis(azanyl)-N-[2-[[4-[2-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]ethylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]amino]ethyl]hexanamide
MOLECULAR FORMULA: C30H44N8O4
MOLECULAR WEIGHT: 580.72156
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCNC(=O)[C@H](CCCCN)N)NCCNC(=O)[C@H](CCCCN)N
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Product OPENEYE NAME: N-[(1S)-1-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S,2S)-1-[[(1S)-5-amino-1-carbamoyl-pentyl]carbamoyl]-2-methyl-butyl]carbamoyl]-4-guanidino-butyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]benzamide
CAS Name: N-[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S,3S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3
IUPAC NAME: N-[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S,3S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3
SYSTEMATIC NAME: N-[(2S)-5-[bis(azanyl)methylideneamino]-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-[bis(azanyl)methylideneamino]-1-[[(2S,3S)-1-[[(2S)-1,6-bis(azanyl)-1-oxidanylidene-hexan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-3-(4-h
MOLECULAR FORMULA: C49H72N14O8
MOLECULAR WEIGHT: 985.18498
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 5-(imidazol-1-ylmethyl)-2-(2-methoxyphenyl)pyridine
CAS Name: 5-(1-imidazolylmethyl)-2-(2-methoxyphenyl)pyridine
IUPAC NAME: 5-(imidazol-1-ylmethyl)-2-(2-methoxyphenyl)pyridine
SYSTEMATIC NAME: 5-(imidazol-1-ylmethyl)-2-(2-methoxyphenyl)pyridine
MOLECULAR FORMULA: C16H15N3O
MOLECULAR WEIGHT: 265.3098
SMILES: COC1=CC=CC=C1C2=NC=C(C=C2)CN3C=CN=C3
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Product OPENEYE NAME: 2-(3,4-difluorophenyl)-5-(imidazol-1-ylmethyl)pyridine
CAS Name: 2-(3,4-difluorophenyl)-5-(1-imidazolylmethyl)pyridine
IUPAC NAME: 2-(3,4-difluorophenyl)-5-(imidazol-1-ylmethyl)pyridine
SYSTEMATIC NAME: 2-[3,4-bis(fluoranyl)phenyl]-5-(imidazol-1-ylmethyl)pyridine
MOLECULAR FORMULA: C15H11F2N3
MOLECULAR WEIGHT: 271.264746
SMILES: C1=CC(=C(C=C1C2=NC=C(C=C2)CN3C=CN=C3)F)F
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Product OPENEYE NAME: 5-(imidazol-1-ylmethyl)-2-(4-methoxyphenyl)pyridine
CAS Name: 5-(1-imidazolylmethyl)-2-(4-methoxyphenyl)pyridine
IUPAC NAME: 5-(imidazol-1-ylmethyl)-2-(4-methoxyphenyl)pyridine
SYSTEMATIC NAME: 5-(imidazol-1-ylmethyl)-2-(4-methoxyphenyl)pyridine
MOLECULAR FORMULA: C16H15N3O
MOLECULAR WEIGHT: 265.3098
SMILES: COC1=CC=C(C=C1)C2=NC=C(C=C2)CN3C=CN=C3
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Product OPENEYE NAME: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxo-oxazolidin-5-yl]methyl]triazole-4-carboxylic acid
CAS Name: 1-[[(5R)-3-(2-dibenzo-p-dioxinyl)-2-oxo-5-oxazolidinyl]methyl]-4-triazolecarboxylic acid
IUPAC NAME: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxo-1,3-oxazolidin-5-yl]methyl]triazole-4-carboxylic acid
SYSTEMATIC NAME: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1,2,3-triazole-4-carboxylic acid
MOLECULAR FORMULA: C19H14N4O6
MOLECULAR WEIGHT: 394.33766
SMILES: C1[C@@H](OC(=O)N1C2=CC3=C(C=C2)OC4=CC=CC=C4O3)CN5C=C(N=N5)C(=O)O
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Product OPENEYE NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furyl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
CAS Name: (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furanyl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f][2]benzopyran-7-carboxylic acid methyl ester
IUPAC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
SYSTEMATIC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-bis(oxidanylidene)-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
MOLECULAR FORMULA: C23H30O8
MOLECULAR WEIGHT: 434.4795
SMILES: C[C@@]12CC[C@H]3C(=O)O[C@@H](C[C@@]3([C@H]1C(=O)[C@H](C[C@H]2C(=O)OC)OCOC)C)C4=COC=C4
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Product OPENEYE NAME: N',N'-diethyl-N-(2-methylsulfanylthiazolo[5,4-b]quinolin-9-yl)ethane-1,2-diamine
CAS Name: N',N'-diethyl-N-[2-(methylthio)-9-thiazolo[5,4-b]quinolinyl]ethane-1,2-diamine
IUPAC NAME: N',N'-diethyl-N-(2-methylsulfanyl-[1,3]thiazolo[5,4-b]quinolin-9-yl)ethane-1,2-diamine
SYSTEMATIC NAME: N',N'-diethyl-N-(2-methylsulfanyl-[1,3]thiazolo[5,4-b]quinolin-9-yl)ethane-1,2-diamine
MOLECULAR FORMULA: C17H22N4S2
MOLECULAR WEIGHT: 346.51338
SMILES: CCN(CC)CCNC1=C2C(=NC3=CC=CC=C31)SC(=N2)SC
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