methyl 4-methylsulfanyl-2-oxidanylidene-6-pyridin-4-yl-pyran-3-carboxylate

Systemtic Name: methyl 4-methylsulfanyl-2-oxidanylidene-6-pyridin-4-yl-pyran-3-carboxylate Openeye Name: methyl 4-methylsulfanyl-2-oxo-6-(4-pyridyl)pyran-3-carboxylate CAS Name: 4-(methylthio)-2-oxo-6-pyridin-4-yl-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-oxo-6-pyridin-4-ylpyran-3-carboxylate Traditional Name: 2-keto-4-(methylthio)-6-(4-pyridyl)pyran-3-carboxylic acid methyl ester Formula: C13H11NO4S MolecularWeight: 277.29574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(OC1=O)C2=CC=NC=C2)SC

Isomeric SMILES

COC(=O)C1=C(C=C(OC1=O)C2=CC=NC=C2)SC

InChI

InChI=1S/C13H11NO4S/c1-17-12(15)11-10(19-2)7-9(18-13(11)16)8-3-5-14-6-4-8/h3-7H,1-2H3