methyl 3-[methyl-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfamoyl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[methyl-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfamoyl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[methyl-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfamoyl]benzothiophene-2-carboxylate CAS Name: 3-[methyl-[2-[3-(methylthio)anilino]-2-oxoethyl]sulfamoyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[methyl-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfamoyl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[2-keto-2-[3-(methylthio)anilino]ethyl]-methyl-sulfamoyl]benzothiophene-2-carboxylic acid methyl ester Formula: C20H20N2O5S3 MolecularWeight: 464.5782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O5S3/c1-22(12-17(23)21-13-7-6-8-14(11-13)28-3)30(25,26)19-15-9-4-5-10-16(15)29-18(19)20(24)27-2/h4-11H,12H2,1-3H3,(H,21,23)