3-[(3-chlorophenyl)sulfanylmethyl]pyridine-2-carboxylic acid

Systemtic Name: 3-[(3-chlorophenyl)sulfanylmethyl]pyridine-2-carboxylic acid Openeye Name: 3-[(3-chlorophenyl)sulfanylmethyl]pyridine-2-carboxylic acid CAS Name: 3-[[(3-chlorophenyl)thio]methyl]-2-pyridinecarboxylic acid IUPAC Name: 3-[(3-chlorophenyl)sulfanylmethyl]pyridine-2-carboxylic acid Traditional Name: 3-[[(3-chlorophenyl)thio]methyl]picolinic acid Formula: C13H10ClNO2S MolecularWeight: 279.742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)SCC2=C(N=CC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)SCC2=C(N=CC=C2)C(=O)O

InChI

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