2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-(4-methylsulfanylphenoxy)-3-phenyl-butanoic acid

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-(4-methylsulfanylphenoxy)-3-phenyl-butanoic acid Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-(4-methylsulfanylphenoxy)-3-phenyl-butanoic acid CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-3-[4-(methylthio)phenoxy]-3-phenylbutanoic acid IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-(4-methylsulfanylphenoxy)-3-phenylbutanoic acid Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-[4-(methylthio)phenoxy]-3-phenyl-butyric acid Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(C(=O)O)OC2=NC(=CC(=N2)OC)OC)OC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C1=CC=CC=C1)(C(C(=O)O)OC2=NC(=CC(=N2)OC)OC)OC3=CC=C(C=C3)SC

InChI

InChI=1S/C23H24N2O6S/c1-23(15-8-6-5-7-9-15,31-16-10-12-17(32-4)13-11-16)20(21(26)27)30-22-24-18(28-2)14-19(25-22)29-3/h5-14,20H,1-4H3,(H,26,27)