2-(5-ethoxycarbonyl-1,4-dimethyl-imidazol-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(5-ethoxycarbonyl-1,4-dimethyl-imidazol-2-yl)sulfanylethanoic acid Openeye Name: 2-(5-ethoxycarbonyl-1,4-dimethyl-imidazol-2-yl)sulfanylacetic acid CAS Name: 2-[(5-ethoxycarbonyl-1,4-dimethyl-2-imidazolyl)thio]acetic acid IUPAC Name: 2-(5-ethoxycarbonyl-1,4-dimethylimidazol-2-yl)sulfanylacetic acid Traditional Name: 2-[(5-carbethoxy-1,4-dimethyl-imidazol-2-yl)thio]acetic acid Formula: C10H14N2O4S MolecularWeight: 258.29416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1C)SCC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1C)SCC(=O)O)C

InChI

InChI=1S/C10H14N2O4S/c1-4-16-9(15)8-6(2)11-10(12(8)3)17-5-7(13)14/h4-5H2,1-3H3,(H,13,14)