methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenoxy-3-phenyl-butanoate

Systemtic Name: methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenoxy-3-phenyl-butanoate Openeye Name: methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenoxy-3-phenyl-butanoate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3-phenoxy-3-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenoxy-3-phenylbutanoate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-3-phenoxy-3-phenyl-butyric acid methyl ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(C(=O)OC)SC2=NC(=CC(=N2)OC)OC)OC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1)(C(C(=O)OC)SC2=NC(=CC(=N2)OC)OC)OC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5S/c1-23(16-11-7-5-8-12-16,30-17-13-9-6-10-14-17)20(21(26)29-4)31-22-24-18(27-2)15-19(25-22)28-3/h5-15,20H,1-4H3