ethyl 3-(dimethylcarbamoylcarbamoyl)-2-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 3-(dimethylcarbamoylcarbamoyl)-2-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 2-[[4-[benzyl(methyl)sulfamoyl]benzoyl]amino]-3-(dimethylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-[[[dimethylamino(oxo)methyl]amino]-oxomethyl]-2-[[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-[benzyl(methyl)sulfamoyl]benzoyl]amino]-3-(dimethylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-[[4-[benzyl(methyl)sulfamoyl]benzoyl]amino]-3-(dimethylcarbamoylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C29H33N5O7S2 MolecularWeight: 627.73162

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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)N(C)CC4=CC=CC=C4

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)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C29H33N5O7S2/c1-5-41-29(38)34-16-15-22-23(18-34)42-27(24(22)26(36)31-28(37)32(2)3)30-25(35)20-11-13-21(14-12-20)43(39,40)33(4)17-19-9-7-6-8-10-19/h6-14H,5,15-18H2,1-4H3,(H,30,35)(H,31,36,37)