3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-anilino-3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-anilino-3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-anilino-3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-anilino-3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C25H20FN5O2 MolecularWeight: 441.457003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4=CC=CC=C4)NC5=CC=CC=C5)F

Isomeric SMILES

COC1=CC(=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4=CC=CC=C4)NC5=CC=CC=C5)F

InChI

InChI=1S/C25H20FN5O2/c1-33-20-12-13-22(21(26)14-20)30-16-17-15-27-24(28-18-8-4-2-5-9-18)29-23(17)31(25(30)32)19-10-6-3-7-11-19/h2-15H,16H2,1H3,(H,27,28,29)