cyanomethyl 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: cyanomethyl 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Openeye Name: cyanomethyl 2-(p-tolylsulfanyl)pyridine-3-carboxylate CAS Name: 2-[(4-methylphenyl)thio]-3-pyridinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-(p-tolylthio)nicotinic acid cyanomethyl ester Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O2S/c1-11-4-6-12(7-5-11)20-14-13(3-2-9-17-14)15(18)19-10-8-16/h2-7,9H,10H2,1H3