(2-chlorophenyl) 2-[(4-methylphenyl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: (2-chlorophenyl) 2-[(4-methylphenyl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: (2-chlorophenyl) 2-(p-tolylmethylsulfanyl)pyridine-3-carboxylate CAS Name: 2-[(4-methylphenyl)methylthio]-3-pyridinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 2-[(4-methylphenyl)methylsulfanyl]pyridine-3-carboxylate Traditional Name: 2-[(4-methylbenzyl)thio]nicotinic acid (2-chlorophenyl) ester Formula: C20H16ClNO2S MolecularWeight: 369.86454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

InChI

InChI=1S/C20H16ClNO2S/c1-14-8-10-15(11-9-14)13-25-19-16(5-4-12-22-19)20(23)24-18-7-3-2-6-17(18)21/h2-12H,13H2,1H3