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

Systemtic Name: 7-[(4-azanylcyclohexyl)amino]-1-cyclopropyl-3-(3-ethoxy-2-fluoranyl-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopropyl-3-(3-ethoxy-2-fluoro-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopropyl-3-(3-ethoxy-2-fluorophenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopropyl-3-(3-ethoxy-2-fluorophenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-[(4-aminocyclohexyl)amino]-1-cyclopropyl-3-(3-ethoxy-2-fluoro-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C23H29FN6O2 MolecularWeight: 440.513763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1F)N2CC3=CN=C(N=C3N(C2=O)C4CC4)NC5CCC(CC5)N

Isomeric SMILES

CCOC1=CC=CC(=C1F)N2CC3=CN=C(N=C3N(C2=O)C4CC4)NC5CCC(CC5)N

InChI

InChI=1S/C23H29FN6O2/c1-2-32-19-5-3-4-18(20(19)24)29-13-14-12-26-22(27-16-8-6-15(25)7-9-16)28-21(14)30(23(29)31)17-10-11-17/h3-5,12,15-17H,2,6-11,13,25H2,1H3,(H,26,27,28)