[3-(2-methylsulfanylpyridin-3-yl)carbonyloxy-2-oxidanylidene-propyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [3-(2-methylsulfanylpyridin-3-yl)carbonyloxy-2-oxidanylidene-propyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [3-(2-methylsulfanylpyridine-3-carbonyl)oxy-2-oxo-propyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [3-[[2-(methylthio)-3-pyridinyl]-oxomethoxy]-2-oxopropyl] ester IUPAC Name: [3-(2-methylsulfanylpyridine-3-carbonyl)oxy-2-oxopropyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-keto-3-[2-(methylthio)nicotinoyl]oxy-propyl] ester Formula: C17H16N2O5S2 MolecularWeight: 392.44934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S2/c1-25-14-12(5-3-7-18-14)16(21)23-9-11(20)10-24-17(22)13-6-4-8-19-15(13)26-2/h3-8H,9-10H2,1-2H3