2-chloranyl-6-phenylsulfanyl-pyridine-4-carboxylic acid

Systemtic Name: 2-chloranyl-6-phenylsulfanyl-pyridine-4-carboxylic acid Openeye Name: 2-chloro-6-phenylsulfanyl-pyridine-4-carboxylic acid CAS Name: 2-chloro-6-(phenylthio)-4-pyridinecarboxylic acid IUPAC Name: 2-chloro-6-phenylsulfanylpyridine-4-carboxylic acid Traditional Name: 2-chloro-6-(phenylthio)isonicotinic acid Formula: C12H8ClNO2S MolecularWeight: 265.71542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8ClNO2S/c13-10-6-8(12(15)16)7-11(14-10)17-9-4-2-1-3-5-9/h1-7H,(H,15,16)