2-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]thio]nicotinic acid Formula: C15H13ClN2O3S MolecularWeight: 336.79332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)O)Cl

InChI

InChI=1S/C15H13ClN2O3S/c1-9-4-5-10(7-12(9)16)18-13(19)8-22-14-11(15(20)21)3-2-6-17-14/h2-7H,8H2,1H3,(H,18,19)(H,20,21)