methyl 3-[[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-sulfamoyl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-sulfamoyl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]-methyl-sulfamoyl]benzothiophene-2-carboxylate CAS Name: 3-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]-methylsulfamoyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]-methylsulfamoyl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[2-(3,4-dimethoxyanilino)-2-keto-ethyl]-methyl-sulfamoyl]benzothiophene-2-carboxylic acid methyl ester Formula: C21H22N2O7S2 MolecularWeight: 478.53858

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=C(SC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CN(CC(=O)NC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=C(SC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H22N2O7S2/c1-23(12-18(24)22-13-9-10-15(28-2)16(11-13)29-3)32(26,27)20-14-7-5-6-8-17(14)31-19(20)21(25)30-4/h5-11H,12H2,1-4H3,(H,22,24)