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

Systemtic Name: ethyl 2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: ethyl 2-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]thio]nicotinic acid ethyl ester Formula: C17H17ClN2O3S MolecularWeight: 364.84648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CC=C1)SCC(=O)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=CC=C1)SCC(=O)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C17H17ClN2O3S/c1-3-23-17(22)12-6-5-9-19-16(12)24-10-15(21)20-14-8-4-7-13(18)11(14)2/h4-9H,3,10H2,1-2H3,(H,20,21)