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

Systemtic Name: 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: 2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylate IUPAC Name: 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]nicotinate Formula: C12H10N3O4S- MolecularWeight: 292.2905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2=C(C=CC=N2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSC2=C(C=CC=N2)C(=O)[O-]

InChI

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