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

Systemtic Name: propan-2-yl 2-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: isopropyl 2-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-[3-(methylthio)anilino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-[3-(methylthio)anilino]ethyl]thio]nicotinic acid isopropyl ester Formula: C18H20N2O3S2 MolecularWeight: 376.493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S2/c1-12(2)23-18(22)15-8-5-9-19-17(15)25-11-16(21)20-13-6-4-7-14(10-13)24-3/h4-10,12H,11H2,1-3H3,(H,20,21)