N-(3-chloranyl-4-fluoranyl-phenyl)-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-[4-(1-piperidyl)-1-piperidyl]pyrimido[5,4-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-[4-(1-piperidinyl)-1-piperidinyl]-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimido[5,4-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[6-(4-piperidinopiperidino)pyrimido[5,4-d]pyrimidin-4-yl]amine Formula: C22H25ClFN7 MolecularWeight: 441.932203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C3=NC=C4C(=N3)C(=NC=N4)NC5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C3=NC=C4C(=N3)C(=NC=N4)NC5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C22H25ClFN7/c23-17-12-15(4-5-18(17)24)28-21-20-19(26-14-27-21)13-25-22(29-20)31-10-6-16(7-11-31)30-8-2-1-3-9-30/h4-5,12-14,16H,1-3,6-11H2,(H,26,27,28)