2-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-[(3-methylisoxazol-5-yl)amino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-[(3-methyl-5-isoxazolyl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-2-[(3-methylisoxazol-5-yl)amino]ethyl]thio]nicotinic acid Formula: C12H11N3O4S MolecularWeight: 293.29844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC1=NOC(=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C12H11N3O4S/c1-7-5-10(19-15-7)14-9(16)6-20-11-8(12(17)18)3-2-4-13-11/h2-5H,6H2,1H3,(H,14,16)(H,17,18)