5-oxidanylidene-2-pyridin-4-ylsulfanyl-oxolane-2-carboxylic acid

Systemtic Name: 5-oxidanylidene-2-pyridin-4-ylsulfanyl-oxolane-2-carboxylic acid Openeye Name: 5-oxo-2-(4-pyridylsulfanyl)tetrahydrofuran-2-carboxylic acid CAS Name: 5-oxo-2-(pyridin-4-ylthio)-2-oxolanecarboxylic acid IUPAC Name: 5-oxo-2-pyridin-4-ylsulfanyloxolane-2-carboxylic acid Traditional Name: 5-keto-2-(4-pyridylthio)tetrahydrofuran-2-carboxylic acid Formula: C10H9NO4S MolecularWeight: 239.24776

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1=O)(C(=O)O)SC2=CC=NC=C2

Isomeric SMILES

C1CC(OC1=O)(C(=O)O)SC2=CC=NC=C2

InChI

InChI=1S/C10H9NO4S/c12-8-1-4-10(15-8,9(13)14)16-7-2-5-11-6-3-7/h2-3,5-6H,1,4H2,(H,13,14)