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

Systemtic Name: methyl 4-[methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]carbamoyl]benzoate Openeye Name: methyl 4-[methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]carbamoyl]benzoate CAS Name: 4-[[methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]carbamoyl]benzoate Traditional Name: 4-[[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-carbamoyl]benzoic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-21(12-17(22)20-15-6-4-5-7-16(15)26-3)18(23)13-8-10-14(11-9-13)19(24)25-2/h4-11H,12H2,1-3H3,(H,20,22)