2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanyl-benzoate

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanyl-benzoate Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanyl-benzoate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-(methylthio)benzoate IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanylbenzoate Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(methylthio)benzoate Formula: C14H13N2O5S- MolecularWeight: 321.32842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)SC)C(=O)[O-])OC

Isomeric SMILES

COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)SC)C(=O)[O-])OC

InChI

InChI=1S/C14H14N2O5S/c1-19-10-7-11(20-2)16-14(15-10)21-8-5-4-6-9(22-3)12(8)13(17)18/h4-7H,1-3H3,(H,17,18)/p-1