5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]-2-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]-2-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-benzyl-5-[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]-1H-pyrimidin-6-one CAS Name: 5-[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl]-2-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-benzyl-5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-1H-pyrimidin-6-one Traditional Name: 2-benzyl-5-[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]-1H-pyrimidin-6-one Formula: C28H22FN3O4 MolecularWeight: 483.490383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)OC3=C(C=C(C=C3)C4=CN=C(NC4=O)CC5=CC=CC=C5)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)OC3=C(C=C(C=C3)C4=CN=C(NC4=O)CC5=CC=CC=C5)F

InChI

InChI=1S/C28H22FN3O4/c1-34-25-14-19-22(15-26(25)35-2)30-11-10-23(19)36-24-9-8-18(13-21(24)29)20-16-31-27(32-28(20)33)12-17-6-4-3-5-7-17/h3-11,13-16H,12H2,1-2H3,(H,31,32,33)