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

Systemtic Name: 5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluoranyl-phenyl]-3-methyl-2-[(4-methylphenyl)amino]pyrimidin-4-one Openeye Name: 5-[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]-3-methyl-2-(4-methylanilino)pyrimidin-4-one CAS Name: 5-[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl]-3-methyl-2-(4-methylanilino)-4-pyrimidinone IUPAC Name: 5-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-3-methyl-2-(4-methylanilino)pyrimidin-4-one Traditional Name: 5-[4-[(6,7-dimethoxy-4-quinolyl)oxy]-3-fluoro-phenyl]-3-methyl-2-(p-toluidino)pyrimidin-4-one Formula: C29H25FN4O4 MolecularWeight: 512.531603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC=C(C(=O)N2C)C3=CC(=C(C=C3)OC4=C5C=C(C(=CC5=NC=C4)OC)OC)F

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC=C(C(=O)N2C)C3=CC(=C(C=C3)OC4=C5C=C(C(=CC5=NC=C4)OC)OC)F

InChI

InChI=1S/C29H25FN4O4/c1-17-5-8-19(9-6-17)33-29-32-16-21(28(35)34(29)2)18-7-10-25(22(30)13-18)38-24-11-12-31-23-15-27(37-4)26(36-3)14-20(23)24/h5-16H,1-4H3,(H,32,33)