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

Systemtic Name: 6-(4-azanyl-4-methyl-piperidin-1-yl)-N-(4-chloranyl-3-fluoranyl-phenyl)pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: 6-(4-amino-4-methyl-1-piperidyl)-N-(4-chloro-3-fluoro-phenyl)pyrimido[5,4-d]pyrimidin-4-amine CAS Name: 6-(4-amino-4-methyl-1-piperidinyl)-N-(4-chloro-3-fluorophenyl)-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: 6-(4-amino-4-methylpiperidin-1-yl)-N-(4-chloro-3-fluorophenyl)pyrimido[5,4-d]pyrimidin-4-amine Traditional Name: [6-(4-amino-4-methyl-piperidino)pyrimido[5,4-d]pyrimidin-4-yl]-(4-chloro-3-fluoro-phenyl)amine Formula: C18H19ClFN7 MolecularWeight: 387.841763

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)Cl)F)N

Isomeric SMILES

CC1(CCN(CC1)C2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)Cl)F)N

InChI

InChI=1S/C18H19ClFN7/c1-18(21)4-6-27(7-5-18)17-22-9-14-15(26-17)16(24-10-23-14)25-11-2-3-12(19)13(20)8-11/h2-3,8-10H,4-7,21H2,1H3,(H,23,24,25)