5-chloranyl-6-(4-propan-2-ylphenyl)sulfanyl-pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-(4-propan-2-ylphenyl)sulfanyl-pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-(4-isopropylphenyl)sulfanyl-pyridine-3-carboxylic acid CAS Name: 5-chloro-6-[(4-propan-2-ylphenyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-(4-propan-2-ylphenyl)sulfanylpyridine-3-carboxylic acid Traditional Name: 5-chloro-6-(p-cumenylthio)nicotinic acid Formula: C15H14ClNO2S MolecularWeight: 307.79516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SC2=C(C=C(C=N2)C(=O)O)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC2=C(C=C(C=N2)C(=O)O)Cl

InChI

InChI=1S/C15H14ClNO2S/c1-9(2)10-3-5-12(6-4-10)20-14-13(16)7-11(8-17-14)15(18)19/h3-9H,1-2H3,(H,18,19)