2-[(2-methylsulfanylphenyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[(2-methylsulfanylphenyl)amino]pyridine-3-carboxylic acid Openeye Name: 2-(2-methylsulfanylanilino)pyridine-3-carboxylic acid CAS Name: 2-[2-(methylthio)anilino]-3-pyridinecarboxylic acid IUPAC Name: 2-(2-methylsulfanylanilino)pyridine-3-carboxylic acid Traditional Name: 2-[2-(methylthio)anilino]nicotinic acid Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CSC1=CC=CC=C1NC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C13H12N2O2S/c1-18-11-7-3-2-6-10(11)15-12-9(13(16)17)5-4-8-14-12/h2-8H,1H3,(H,14,15)(H,16,17)