1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-3-(2-fluoranyl-3,5-dimethoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-3-(2-fluoranyl-3,5-dimethoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 1-cyclopentyl-7-[5-(diisopropylamino)pentylamino]-3-(2-fluoro-3,5-dimethoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-3-(2-fluoro-3,5-dimethoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-3-(2-fluoro-3,5-dimethoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 1-cyclopentyl-7-[5-(diisopropylamino)pentylamino]-3-(2-fluoro-3,5-dimethoxy-phenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C30H45FN6O3 MolecularWeight: 556.715103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCCCNC1=NC=C2CN(C(=O)N(C2=N1)C3CCCC3)C4=CC(=CC(=C4F)OC)OC)C(C)C

Isomeric SMILES

CC(C)N(CCCCCNC1=NC=C2CN(C(=O)N(C2=N1)C3CCCC3)C4=CC(=CC(=C4F)OC)OC)C(C)C

InChI

InChI=1S/C30H45FN6O3/c1-20(2)35(21(3)4)15-11-7-10-14-32-29-33-18-22-19-36(25-16-24(39-5)17-26(40-6)27(25)31)30(38)37(28(22)34-29)23-12-8-9-13-23/h16-18,20-21,23H,7-15,19H2,1-6H3,(H,32,33,34)