2-[1-(2,5-dimethoxyphenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-(2,5-dimethoxyphenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-(2,5-dimethoxyphenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(2,5-dimethoxyphenyl)-2-imidazolyl]thio]acetate IUPAC Name: 2-[1-(2,5-dimethoxyphenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2,5-dimethoxyphenyl)imidazol-2-yl]thio]acetate Formula: C13H13N2O4S- MolecularWeight: 293.31832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C=CN=C2SCC(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C=CN=C2SCC(=O)[O-]

InChI

InChI=1S/C13H14N2O4S/c1-18-9-3-4-11(19-2)10(7-9)15-6-5-14-13(15)20-8-12(16)17/h3-7H,8H2,1-2H3,(H,16,17)/p-1