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

Systemtic Name: methyl 3-[methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfamoyl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(2-anilino-2-oxo-ethyl)-methyl-sulfamoyl]benzothiophene-2-carboxylate CAS Name: 3-[(2-anilino-2-oxoethyl)-methylsulfamoyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(2-anilino-2-oxoethyl)-methylsulfamoyl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(2-anilino-2-keto-ethyl)-methyl-sulfamoyl]benzothiophene-2-carboxylic acid methyl ester Formula: C19H18N2O5S2 MolecularWeight: 418.48662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O5S2/c1-21(12-16(22)20-13-8-4-3-5-9-13)28(24,25)18-14-10-6-7-11-15(14)27-17(18)19(23)26-2/h3-11H,12H2,1-2H3,(H,20,22)