methyl 6-(3-methylbutanoyl)-2-(phenylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 6-(3-methylbutanoyl)-2-(phenylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-(3-methylbutanoyl)-2-(phenylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-(3-methyl-1-oxobutyl)-2-(phenylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(3-methylbutanoyl)-2-(phenylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-isovaleryl-2-(phenylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1)SC(=C2C(=O)OC)S(=O)(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1)SC(=C2C(=O)OC)S(=O)(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5S2/c1-13(2)11-17(23)22-10-9-15-16(12-22)28-20(18(15)19(24)27-3)29(25,26)21-14-7-5-4-6-8-14/h4-8,13,21H,9-12H2,1-3H3