methyl 1-[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-(4-methylsulfanylanilino)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[2-[4-(methylthio)anilino]-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-methylsulfanylanilino)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 6-keto-1-[2-keto-2-[4-(methylthio)anilino]ethyl]nicotinic acid methyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H16N2O4S/c1-22-16(21)11-3-8-15(20)18(9-11)10-14(19)17-12-4-6-13(23-2)7-5-12/h3-9H,10H2,1-2H3,(H,17,19)