5-[[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrimidin-2-yl]methyl]-2-methoxy-phenol

Systemtic Name: 5-[[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrimidin-2-yl]methyl]-2-methoxy-phenol Openeye Name: 5-[[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrimidin-2-yl]methyl]-2-methoxy-phenol CAS Name: 5-[[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-pyrimidinyl]methyl]-2-methoxyphenol IUPAC Name: 5-[[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrimidin-2-yl]methyl]-2-methoxyphenol Traditional Name: 5-[[4-(4-fluorophenyl)-5-(4-mesylphenyl)pyrimidin-2-yl]methyl]-2-methoxy-phenol Formula: C25H21FN2O4S MolecularWeight: 464.508643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC=C(C(=N2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)S(=O)(=O)C)O

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC=C(C(=N2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)S(=O)(=O)C)O

InChI

InChI=1S/C25H21FN2O4S/c1-32-23-12-3-16(13-22(23)29)14-24-27-15-21(17-6-10-20(11-7-17)33(2,30)31)25(28-24)18-4-8-19(26)9-5-18/h3-13,15,29H,14H2,1-2H3