methyl 4-[2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyloxy]ethanoyloxy]benzoate

Systemtic Name: methyl 4-[2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoyloxy]ethanoyloxy]benzoate Openeye Name: methyl 4-[2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]oxyacetyl]oxybenzoate CAS Name: 4-[2-[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethoxy]-1-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]oxyacetyl]oxybenzoate Traditional Name: 4-[2-[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]oxyacetyl]oxybenzoic acid methyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)OCC(=O)OC2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)OCC(=O)OC2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C18H18N2O6S/c1-11-8-12(2)20-18(19-11)27-10-16(22)25-9-15(21)26-14-6-4-13(5-7-14)17(23)24-3/h4-8H,9-10H2,1-3H3