ethyl 3-(dimethylcarbamoylcarbamoyl)-2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 3-(dimethylcarbamoylcarbamoyl)-2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 3-(dimethylcarbamoylcarbamoyl)-2-[[4-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-[[[dimethylamino(oxo)methyl]amino]-oxomethyl]-2-[[[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(dimethylcarbamoylcarbamoyl)-2-[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-(dimethylcarbamoylcarbamoyl)-2-[[4-(4-methylpiperidino)sulfonylbenzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C27H35N5O7S2 MolecularWeight: 605.7261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC(=O)N(C)C)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C

Isomeric SMILES

CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC(=O)N(C)C)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)C

InChI

InChI=1S/C27H35N5O7S2/c1-5-39-27(36)31-13-12-20-21(16-31)40-25(22(20)24(34)29-26(35)30(3)4)28-23(33)18-6-8-19(9-7-18)41(37,38)32-14-10-17(2)11-15-32/h6-9,17H,5,10-16H2,1-4H3,(H,28,33)(H,29,34,35)