2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoic acid Openeye Name: 2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylacetic acid CAS Name: 2-[(1-methyl-5-phenyl-2-imidazolyl)thio]acetic acid IUPAC Name: 2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetic acid Traditional Name: 2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CN1C(=CN=C1SCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2S/c1-14-10(9-5-3-2-4-6-9)7-13-12(14)17-8-11(15)16/h2-7H,8H2,1H3,(H,15,16)