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

Systemtic Name: 2-(5-ethoxycarbonyl-1,4-dimethyl-imidazol-2-yl)sulfanylethanoate Openeye Name: 2-(5-ethoxycarbonyl-1,4-dimethyl-imidazol-2-yl)sulfanylacetate CAS Name: 2-[(5-ethoxycarbonyl-1,4-dimethyl-2-imidazolyl)thio]acetate IUPAC Name: 2-(5-ethoxycarbonyl-1,4-dimethylimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(5-carbethoxy-1,4-dimethyl-imidazol-2-yl)thio]acetate Formula: C10H13N2O4S- MolecularWeight: 257.28622

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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)/p-1