[4-[(2-methylsulfanylpyridin-3-yl)carbonyloxymethyl]phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [4-[(2-methylsulfanylpyridin-3-yl)carbonyloxymethyl]phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [4-[(2-methylsulfanylpyridine-3-carbonyl)oxymethyl]phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [4-[[[2-(methylthio)-3-pyridinyl]-oxomethoxy]methyl]phenyl]methyl ester IUPAC Name: [4-[(2-methylsulfanylpyridine-3-carbonyl)oxymethyl]phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [4-[[2-(methylthio)nicotinoyl]oxymethyl]benzyl] ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC2=CC=C(C=C2)COC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC2=CC=C(C=C2)COC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C22H20N2O4S2/c1-29-19-17(5-3-11-23-19)21(25)27-13-15-7-9-16(10-8-15)14-28-22(26)18-6-4-12-24-20(18)30-2/h3-12H,13-14H2,1-2H3