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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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