2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: 2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: 2-[2-(2-methylanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-(2-methylanilino)-2-oxoethyl]thio]-3-pyridinecarboxylate IUPAC Name: 2-[2-(2-methylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-(o-toluidino)ethyl]thio]nicotinate Formula: C15H13N2O3S- MolecularWeight: 301.34032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=C(C=CC=N2)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=C(C=CC=N2)C(=O)[O-]

InChI

InChI=1S/C15H14N2O3S/c1-10-5-2-3-7-12(10)17-13(18)9-21-14-11(15(19)20)6-4-8-16-14/h2-8H,9H2,1H3,(H,17,18)(H,19,20)/p-1