propan-2-yl 2-[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: propan-2-yl 2-[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: isopropyl 2-[2-(2-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-(2-chloro-4-methylanilino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-(2-chloro-4-methylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-(2-chloro-4-methyl-anilino)-2-keto-ethyl]thio]nicotinic acid isopropyl ester Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O3S/c1-11(2)24-18(23)13-5-4-8-20-17(13)25-10-16(22)21-15-7-6-12(3)9-14(15)19/h4-9,11H,10H2,1-3H3,(H,21,22)