2-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-(2-anilino-1-methyl-2-oxo-ethyl)sulfanylpyridine-3-carboxylic acid CAS Name: 2-[(1-anilino-1-oxopropan-2-yl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(1-anilino-1-oxopropan-2-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(2-anilino-2-keto-1-methyl-ethyl)thio]nicotinic acid Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O3S/c1-10(13(18)17-11-6-3-2-4-7-11)21-14-12(15(19)20)8-5-9-16-14/h2-10H,1H3,(H,17,18)(H,19,20)