2-[2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(furan-2-carbonylamino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-[[2-furanyl(oxo)methyl]amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(furan-2-carbonylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-(2-furoylamino)-2-keto-ethyl]thio]nicotinic acid Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NC(=O)C2=CC=CO2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NC(=O)C2=CC=CO2)C(=O)O

InChI

InChI=1S/C13H10N2O5S/c16-10(15-11(17)9-4-2-6-20-9)7-21-12-8(13(18)19)3-1-5-14-12/h1-6H,7H2,(H,18,19)(H,15,16,17)