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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-(1-methylpiperidin-3-yl)oxy-pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-[(1-methyl-3-piperidyl)oxy]pyrimido[5,4-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-[(1-methyl-3-piperidinyl)oxy]-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-(1-methylpiperidin-3-yl)oxypyrimido[5,4-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[6-[(1-methyl-3-piperidyl)oxy]pyrimido[5,4-d]pyrimidin-4-yl]amine Formula: C18H18ClFN6O MolecularWeight: 388.826523

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)OC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CN1CCCC(C1)OC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C18H18ClFN6O/c1-26-6-2-3-12(9-26)27-18-21-8-15-16(25-18)17(23-10-22-15)24-11-4-5-14(20)13(19)7-11/h4-5,7-8,10,12H,2-3,6,9H2,1H3,(H,22,23,24)