methyl 4,5-dimethoxy-2-[[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[2-(3-methylsulfanylanilino)-2-oxo-ethyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[2-[3-(methylthio)anilino]-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[2-(3-methylsulfanylanilino)-2-oxoethyl]amino]benzoate Traditional Name: 2-[[2-keto-2-[3-(methylthio)anilino]ethyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NCC(=O)NC2=CC(=CC=C2)SC)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NCC(=O)NC2=CC(=CC=C2)SC)OC

InChI

InChI=1S/C19H22N2O5S/c1-24-16-9-14(19(23)26-3)15(10-17(16)25-2)20-11-18(22)21-12-6-5-7-13(8-12)27-4/h5-10,20H,11H2,1-4H3,(H,21,22)