(2-chlorophenyl) 2-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: (2-chlorophenyl) 2-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: (2-chlorophenyl) 2-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-[3-(methylthio)anilino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 2-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-[3-(methylthio)anilino]ethyl]thio]nicotinic acid (2-chlorophenyl) ester Formula: C21H17ClN2O3S2 MolecularWeight: 444.95428

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

InChI

InChI=1S/C21H17ClN2O3S2/c1-28-15-7-4-6-14(12-15)24-19(25)13-29-20-16(8-5-11-23-20)21(26)27-18-10-3-2-9-17(18)22/h2-12H,13H2,1H3,(H,24,25)