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

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-3-methoxy-5-oxidanyl-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-(2-chloro-6-fluoro-5-hydroxy-3-methoxy-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(2-chloro-6-fluoro-5-hydroxy-3-methoxyphenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(2-chloro-6-fluoro-5-hydroxy-3-methoxyphenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-(2-chloro-6-fluoro-5-hydroxy-3-methoxy-phenyl)-1-cyclopropyl-7-[[4-(dimethylamino)cyclohexyl]amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C24H30ClFN6O3 MolecularWeight: 504.984803

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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)O)F

Isomeric SMILES

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

InChI

InChI=1S/C24H30ClFN6O3/c1-30(2)15-6-4-14(5-7-15)28-23-27-11-13-12-31(24(34)32(16-8-9-16)22(13)29-23)21-19(25)18(35-3)10-17(33)20(21)26/h10-11,14-16,33H,4-9,12H2,1-3H3,(H,27,28,29)