N6-(1-methylpiperidin-4-yl)-N4-(4-phenoxyphenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6-(1-methylpiperidin-4-yl)-N4-(4-phenoxyphenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N6-(1-methyl-4-piperidyl)-N4-(4-phenoxyphenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N6-(1-methyl-4-piperidinyl)-N4-(4-phenoxyphenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-(1-methylpiperidin-4-yl)-4-N-(4-phenoxyphenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: (1-methyl-4-piperidyl)-[4-(4-phenoxyanilino)pyrimido[5,4-d]pyrimidin-6-yl]amine Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CN1CCC(CC1)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C24H25N7O/c1-31-13-11-18(12-14-31)29-24-25-15-21-22(30-24)23(27-16-26-21)28-17-7-9-20(10-8-17)32-19-5-3-2-4-6-19/h2-10,15-16,18H,11-14H2,1H3,(H,25,29,30)(H,26,27,28)