methyl 6-(1-methylpyrrol-2-yl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 6-(1-methylpyrrol-2-yl)-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 6-(1-methylpyrrol-2-yl)-4-methylsulfanyl-2-oxo-pyran-3-carboxylate CAS Name: 6-(1-methyl-2-pyrrolyl)-4-(methylthio)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-(1-methylpyrrol-2-yl)-4-methylsulfanyl-2-oxopyran-3-carboxylate Traditional Name: 2-keto-6-(1-methylpyrrol-2-yl)-4-(methylthio)pyran-3-carboxylic acid methyl ester Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=CC(=C(C(=O)O2)C(=O)OC)SC

Isomeric SMILES

CN1C=CC=C1C2=CC(=C(C(=O)O2)C(=O)OC)SC

InChI

InChI=1S/C13H13NO4S/c1-14-6-4-5-8(14)9-7-10(19-3)11(12(15)17-2)13(16)18-9/h4-7H,1-3H3