6-(4-acetamidophenyl)sulfanyl-5-chloranyl-pyridine-3-carboxylic acid

Systemtic Name: 6-(4-acetamidophenyl)sulfanyl-5-chloranyl-pyridine-3-carboxylic acid Openeye Name: 6-(4-acetamidophenyl)sulfanyl-5-chloro-pyridine-3-carboxylic acid CAS Name: 6-[(4-acetamidophenyl)thio]-5-chloro-3-pyridinecarboxylic acid IUPAC Name: 6-(4-acetamidophenyl)sulfanyl-5-chloropyridine-3-carboxylic acid Traditional Name: 6-[(4-acetamidophenyl)thio]-5-chloro-nicotinic acid Formula: C14H11ClN2O3S MolecularWeight: 322.76674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC2=C(C=C(C=N2)C(=O)O)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC2=C(C=C(C=N2)C(=O)O)Cl

InChI

InChI=1S/C14H11ClN2O3S/c1-8(18)17-10-2-4-11(5-3-10)21-13-12(15)6-9(7-16-13)14(19)20/h2-7H,1H3,(H,17,18)(H,19,20)