6-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 6-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylic acid Openeye Name: 6-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylic acid CAS Name: 6-[(1-methyl-2-imidazolyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 6-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 6-[(1-methylimidazol-2-yl)thio]nicotinic acid Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C=CN=C1SC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C10H9N3O2S/c1-13-5-4-11-10(13)16-8-3-2-7(6-12-8)9(14)15/h2-6H,1H3,(H,14,15)