2-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylate

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylate Openeye Name: 2-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-3-pyridinecarboxylate IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(1-methylimidazol-2-yl)thio]nicotinate Formula: C10H8N3O2S- MolecularWeight: 234.25442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=CC=N2)C(=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=CC=N2)C(=O)[O-]

InChI

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