2-(1-methylimidazol-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanylethanoic acid Openeye Name: 2-(1-methylimidazol-2-yl)sulfanylacetic acid CAS Name: 2-[(1-methyl-2-imidazolyl)thio]acetic acid IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanylacetic acid Traditional Name: 2-[(1-methylimidazol-2-yl)thio]acetic acid Formula: C6H8N2O2S MolecularWeight: 172.20492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)O

Isomeric SMILES

CN1C=CN=C1SCC(=O)O

InChI

InChI=1S/C6H8N2O2S/c1-8-3-2-7-6(8)11-4-5(9)10/h2-3H,4H2,1H3,(H,9,10)