1-cyclopentyl-7-[[4-(dimethylamino)cyclohexyl]amino]-3-(2-fluoranyl-5-methoxy-3-oxidanyl-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 1-cyclopentyl-7-[[4-(dimethylamino)cyclohexyl]amino]-3-(2-fluoranyl-5-methoxy-3-oxidanyl-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 1-cyclopentyl-7-[[4-(dimethylamino)cyclohexyl]amino]-3-(2-fluoro-3-hydroxy-5-methoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 1-cyclopentyl-7-[[4-(dimethylamino)cyclohexyl]amino]-3-(2-fluoro-3-hydroxy-5-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 1-cyclopentyl-7-[[4-(dimethylamino)cyclohexyl]amino]-3-(2-fluoro-3-hydroxy-5-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 1-cyclopentyl-7-[[4-(dimethylamino)cyclohexyl]amino]-3-(2-fluoro-3-hydroxy-5-methoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C26H35FN6O3 MolecularWeight: 498.592903

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)NC2=NC=C3CN(C(=O)N(C3=N2)C4CCCC4)C5=CC(=CC(=C5F)O)OC

Isomeric SMILES

CN(C)C1CCC(CC1)NC2=NC=C3CN(C(=O)N(C3=N2)C4CCCC4)C5=CC(=CC(=C5F)O)OC

InChI

InChI=1S/C26H35FN6O3/c1-31(2)18-10-8-17(9-11-18)29-25-28-14-16-15-32(21-12-20(36-3)13-22(34)23(21)27)26(35)33(24(16)30-25)19-6-4-5-7-19/h12-14,17-19,34H,4-11,15H2,1-3H3,(H,28,29,30)