3-(2-chloranyl-6-fluoranyl-3,5-dimethoxy-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-3,5-dimethoxy-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-(2-chloro-6-fluoro-3,5-dimethoxy-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(2-chloro-6-fluoro-3,5-dimethoxyphenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(2-chloro-6-fluoro-3,5-dimethoxyphenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-(2-chloro-6-fluoro-3,5-dimethoxy-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C25H32ClFN6O3 MolecularWeight: 519.011383

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)NC2=NC=C3CN(C(=O)N(C3=N2)C4CC4)C5=C(C(=CC(=C5Cl)OC)OC)F

Isomeric SMILES

CN(C)C1CCC(CC1)NC2=NC=C3CN(C(=O)N(C3=N2)C4CC4)C5=C(C(=CC(=C5Cl)OC)OC)F

InChI

InChI=1S/C25H32ClFN6O3/c1-31(2)16-7-5-15(6-8-16)29-24-28-12-14-13-32(25(34)33(17-9-10-17)23(14)30-24)22-20(26)18(35-3)11-19(36-4)21(22)27/h11-12,15-17H,5-10,13H2,1-4H3,(H,28,29,30)