2-chloranyl-6-(4-methylphenyl)sulfanyl-pyridine-4-carboxylic acid

Systemtic Name: 2-chloranyl-6-(4-methylphenyl)sulfanyl-pyridine-4-carboxylic acid Openeye Name: 2-chloro-6-(p-tolylsulfanyl)pyridine-4-carboxylic acid CAS Name: 2-chloro-6-[(4-methylphenyl)thio]-4-pyridinecarboxylic acid IUPAC Name: 2-chloro-6-(4-methylphenyl)sulfanylpyridine-4-carboxylic acid Traditional Name: 2-chloro-6-(p-tolylthio)isonicotinic acid Formula: C13H10ClNO2S MolecularWeight: 279.742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC(=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC(=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C13H10ClNO2S/c1-8-2-4-10(5-3-8)18-12-7-9(13(16)17)6-11(14)15-12/h2-7H,1H3,(H,16,17)