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

Systemtic Name: 7-[(4-azanylcyclohexyl)amino]-1-cyclopentyl-3-(2-fluoranyl-3-methoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopentyl-3-(2-fluoro-3-methoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopentyl-3-(2-fluoro-3-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopentyl-3-(2-fluoro-3-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopentyl-3-(2-fluoro-3-methoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C24H31FN6O2 MolecularWeight: 454.540343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1F)N2CC3=CN=C(N=C3N(C2=O)C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

COC1=CC=CC(=C1F)N2CC3=CN=C(N=C3N(C2=O)C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C24H31FN6O2/c1-33-20-8-4-7-19(21(20)25)30-14-15-13-27-23(28-17-11-9-16(26)10-12-17)29-22(15)31(24(30)32)18-5-2-3-6-18/h4,7-8,13,16-18H,2-3,5-6,9-12,14,26H2,1H3,(H,27,28,29)