3-(2-chloranyl-6-fluoranyl-3,5-dimethoxy-phenyl)-1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-3,5-dimethoxy-phenyl)-1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-(2-chloro-6-fluoro-3,5-dimethoxy-phenyl)-1-cyclopentyl-7-[5-(diisopropylamino)pentylamino]-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(2-chloro-6-fluoro-3,5-dimethoxyphenyl)-1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(2-chloro-6-fluoro-3,5-dimethoxyphenyl)-1-cyclopentyl-7-[5-[di(propan-2-yl)amino]pentylamino]-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-(2-chloro-6-fluoro-3,5-dimethoxy-phenyl)-1-cyclopentyl-7-[5-(diisopropylamino)pentylamino]-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C30H44ClFN6O3 MolecularWeight: 591.160163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCCCNC1=NC=C2CN(C(=O)N(C2=N1)C3CCCC3)C4=C(C(=CC(=C4Cl)OC)OC)F)C(C)C

Isomeric SMILES

CC(C)N(CCCCCNC1=NC=C2CN(C(=O)N(C2=N1)C3CCCC3)C4=C(C(=CC(=C4Cl)OC)OC)F)C(C)C

InChI

InChI=1S/C30H44ClFN6O3/c1-19(2)36(20(3)4)15-11-7-10-14-33-29-34-17-21-18-37(27-25(31)23(40-5)16-24(41-6)26(27)32)30(39)38(28(21)35-29)22-12-8-9-13-22/h16-17,19-20,22H,7-15,18H2,1-6H3,(H,33,34,35)