(2-azanyl-2-oxidanylidene-ethyl) 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 2-(p-tolylsulfanyl)pyridine-3-carboxylate CAS Name: 2-[(4-methylphenyl)thio]-3-pyridinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-(p-tolylthio)nicotinic acid (2-amino-2-keto-ethyl) ester Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)OCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)OCC(=O)N

InChI

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