8-[2,6-bis(fluoranyl)phenyl]-4-chloranyl-2-(4-pyrrolidin-1-ylpiperidin-1-yl)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one

Systemtic Name: 8-[2,6-bis(fluoranyl)phenyl]-4-chloranyl-2-(4-pyrrolidin-1-ylpiperidin-1-yl)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Openeye Name: 4-chloro-8-(2,6-difluorophenyl)-2-(4-pyrrolidin-1-yl-1-piperidyl)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one CAS Name: 4-chloro-8-(2,6-difluorophenyl)-2-[4-(1-pyrrolidinyl)-1-piperidinyl]-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one IUPAC Name: 4-chloro-8-(2,6-difluorophenyl)-2-(4-pyrrolidin-1-ylpiperidin-1-yl)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Traditional Name: 4-chloro-8-(2,6-difluorophenyl)-2-(4-pyrrolidinopiperidino)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Formula: C21H23ClF2N6O MolecularWeight: 448.896726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCN(CC2)C3=NC4=C(CNC(=O)N4C5=C(C=CC=C5F)F)C(=N3)Cl

Isomeric SMILES

C1CCN(C1)C2CCN(CC2)C3=NC4=C(CNC(=O)N4C5=C(C=CC=C5F)F)C(=N3)Cl

InChI

InChI=1S/C21H23ClF2N6O/c22-18-14-12-25-21(31)30(17-15(23)4-3-5-16(17)24)19(14)27-20(26-18)29-10-6-13(7-11-29)28-8-1-2-9-28/h3-5,13H,1-2,6-12H2,(H,25,31)