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

Systemtic Name: (4-methoxyphenyl)methyl 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanyl-benzoate Openeye Name: (4-methoxyphenyl)methyl 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanyl-benzoate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-(methylthio)benzoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylsulfanylbenzoate Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(methylthio)benzoic acid p-anisyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C2=C(C=CC=C2SC)OC3=NC(=CC(=N3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)C2=C(C=CC=C2SC)OC3=NC(=CC(=N3)OC)OC

InChI

InChI=1S/C22H22N2O6S/c1-26-15-10-8-14(9-11-15)13-29-21(25)20-16(6-5-7-17(20)31-4)30-22-23-18(27-2)12-19(24-22)28-3/h5-12H,13H2,1-4H3