methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-diphenyl-propanoate

Systemtic Name: methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-diphenyl-propanoate Openeye Name: methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-diphenyl-propanoate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3,3-diphenylpropanoic acid methyl ester IUPAC Name: methyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-diphenylpropanoate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-3,3-diphenyl-propionic acid methyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC(C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC(C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)OC

InChI

InChI=1S/C22H22N2O4S/c1-26-17-14-18(27-2)24-22(23-17)29-20(21(25)28-3)19(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14,19-20H,1-3H3