methyl 4-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfamoyl]benzoate Openeye Name: methyl 4-[methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]sulfamoyl]benzoate CAS Name: 4-[methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]sulfamoyl]benzoate Traditional Name: 4-[[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-sulfamoyl]benzoic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-20(12-17(21)19-15-6-4-5-7-16(15)26-3)27(23,24)14-10-8-13(9-11-14)18(22)25-2/h4-11H,12H2,1-3H3,(H,19,21)