[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate

Systemtic Name: [2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 6-methylpyridine-3-carboxylate Openeye Name: [2-(4-methylsulfanylanilino)-2-oxo-ethyl] 6-methylpyridine-3-carboxylate CAS Name: 6-methyl-3-pyridinecarboxylic acid [2-[4-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylanilino)-2-oxoethyl] 6-methylpyridine-3-carboxylate Traditional Name: 6-methylnicotinic acid [2-keto-2-[4-(methylthio)anilino]ethyl] ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H16N2O3S/c1-11-3-4-12(9-17-11)16(20)21-10-15(19)18-13-5-7-14(22-2)8-6-13/h3-9H,10H2,1-2H3,(H,18,19)