1-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-(1-methylimidazol-2-yl)sulfanylethyl]triazole-4-carboxylate CAS Name: 1-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-(1-methylimidazol-2-yl)sulfanylethyl]triazole-4-carboxylate Traditional Name: 1-[2-[(1-methylimidazol-2-yl)thio]ethyl]triazole-4-carboxylate Formula: C9H10N5O2S- MolecularWeight: 252.273

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCN2C=C(N=N2)C(=O)[O-]

Isomeric SMILES

CN1C=CN=C1SCCN2C=C(N=N2)C(=O)[O-]

InChI

InChI=1S/C9H11N5O2S/c1-13-3-2-10-9(13)17-5-4-14-6-7(8(15)16)11-12-14/h2-3,6H,4-5H2,1H3,(H,15,16)/p-1