2-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-(3-methyl-5-nitro-imidazol-4-yl)sulfanylpyridine-3-carboxylic acid CAS Name: 2-[(3-methyl-5-nitro-4-imidazolyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(3-methyl-5-nitroimidazol-4-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(3-methyl-5-nitro-imidazol-4-yl)thio]nicotinic acid Formula: C10H8N4O4S MolecularWeight: 280.25992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=C(C=CC=N2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=C(C=CC=N2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H8N4O4S/c1-13-5-12-7(14(17)18)9(13)19-8-6(10(15)16)3-2-4-11-8/h2-5H,1H3,(H,15,16)