(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C13H11NO3S2 MolecularWeight: 293.36134

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC(=O)C2=CC=CS2

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC(=O)C2=CC=CS2

InChI

InChI=1S/C13H11NO3S2/c1-18-12-9(4-2-6-14-12)13(16)17-8-10(15)11-5-3-7-19-11/h2-7H,8H2,1H3