(4-chlorophenyl)sulfanylmethyl pyridine-3-carboxylate

Systemtic Name: (4-chlorophenyl)sulfanylmethyl pyridine-3-carboxylate Openeye Name: (4-chlorophenyl)sulfanylmethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [(4-chlorophenyl)thio]methyl ester IUPAC Name: (4-chlorophenyl)sulfanylmethyl pyridine-3-carboxylate Traditional Name: nicotinic acid [(4-chlorophenyl)thio]methyl ester Formula: C13H10ClNO2S MolecularWeight: 279.742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H10ClNO2S/c14-11-3-5-12(6-4-11)18-9-17-13(16)10-2-1-7-15-8-10/h1-8H,9H2