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

Systemtic Name: ethyl 2-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: ethyl 2-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-[3-(methylthio)anilino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-[3-(methylthio)anilino]ethyl]thio]nicotinic acid ethyl ester Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S2/c1-3-22-17(21)14-8-5-9-18-16(14)24-11-15(20)19-12-6-4-7-13(10-12)23-2/h4-10H,3,11H2,1-2H3,(H,19,20)