2-[2-oxidanylidene-2-(2-oxidanylidenepyrrolidin-1-yl)ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-oxidanylidene-2-(2-oxidanylidenepyrrolidin-1-yl)ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-2-(2-ketopyrrolidino)ethyl]thio]nicotinic acid Formula: C12H12N2O4S MolecularWeight: 280.29968

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C(=O)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1)C(=O)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C12H12N2O4S/c15-9-4-2-6-14(9)10(16)7-19-11-8(12(17)18)3-1-5-13-11/h1,3,5H,2,4,6-7H2,(H,17,18)