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

Systemtic Name: 1-cyclopentyl-3-(2-fluoranyl-3-methoxy-phenyl)-7-[(4-oxidanylcyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 1-cyclopentyl-3-(2-fluoro-3-methoxy-phenyl)-7-[(4-hydroxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 1-cyclopentyl-3-(2-fluoro-3-methoxyphenyl)-7-[(4-hydroxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 1-cyclopentyl-3-(2-fluoro-3-methoxyphenyl)-7-[(4-hydroxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 1-cyclopentyl-3-(2-fluoro-3-methoxy-phenyl)-7-[(4-hydroxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C24H30FN5O3 MolecularWeight: 455.525103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30FN5O3/c1-33-20-8-4-7-19(21(20)25)29-14-15-13-26-23(27-16-9-11-18(31)12-10-16)28-22(15)30(24(29)32)17-5-2-3-6-17/h4,7-8,13,16-18,31H,2-3,5-6,9-12,14H2,1H3,(H,26,27,28)