2-[2-[(4-formamido-1,2,5-oxadiazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-[(4-formamido-1,2,5-oxadiazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-[(4-formamido-1,2,5-oxadiazol-3-yl)amino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-[(4-formamido-1,2,5-oxadiazol-3-yl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[(4-formamido-1,2,5-oxadiazol-3-yl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-[(4-formamidofurazan-3-yl)amino]-2-keto-ethyl]thio]nicotinic acid Formula: C11H9N5O5S MolecularWeight: 323.28466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NC2=NON=C2NC=O)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NC2=NON=C2NC=O)C(=O)O

InChI

InChI=1S/C11H9N5O5S/c17-5-13-8-9(16-21-15-8)14-7(18)4-22-10-6(11(19)20)2-1-3-12-10/h1-3,5H,4H2,(H,19,20)(H,13,15,17)(H,14,16,18)