diethyl 2-oxidanylidene-6-(phenylmethylsulfanyl)-1H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-oxidanylidene-6-(phenylmethylsulfanyl)-1H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 2-benzylsulfanyl-6-oxo-1H-pyridine-3,5-dicarboxylate CAS Name: 2-oxo-6-(phenylmethylthio)-1H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-benzylsulfanyl-6-oxo-1H-pyridine-3,5-dicarboxylate Traditional Name: 2-(benzylthio)-6-keto-1H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(NC1=O)SCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=C(NC1=O)SCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H19NO5S/c1-3-23-17(21)13-10-14(18(22)24-4-2)16(19-15(13)20)25-11-12-8-6-5-7-9-12/h5-10H,3-4,11H2,1-2H3,(H,19,20)