5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]-3-[(2-methylphenyl)methyl]pyrimidin-4-one

Systemtic Name: 5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]-3-[(2-methylphenyl)methyl]pyrimidin-4-one Openeye Name: 5-[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]-3-(o-tolylmethyl)pyrimidin-4-one CAS Name: 5-[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl]-3-[(2-methylphenyl)methyl]-4-pyrimidinone IUPAC Name: 5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-3-[(2-methylphenyl)methyl]pyrimidin-4-one Traditional Name: 5-[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]-3-(2-methylbenzyl)pyrimidin-4-one Formula: C29H24FN3O4 MolecularWeight: 497.516963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=NC=C(C2=O)C3=CC(=C(C=C3)OC4=C5C=C(C(=CC5=NC=C4)OC)OC)F

Isomeric SMILES

CC1=CC=CC=C1CN2C=NC=C(C2=O)C3=CC(=C(C=C3)OC4=C5C=C(C(=CC5=NC=C4)OC)OC)F

InChI

InChI=1S/C29H24FN3O4/c1-18-6-4-5-7-20(18)16-33-17-31-15-22(29(33)34)19-8-9-26(23(30)12-19)37-25-10-11-32-24-14-28(36-3)27(35-2)13-21(24)25/h4-15,17H,16H2,1-3H3