N6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-N2-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine

Systemtic Name: N6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-N2-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Openeye Name: N6-[1-[(4-methoxyphenyl)methyl]-4-piperidyl]-N2-(4-morpholinophenyl)-7H-purine-2,6-diamine CAS Name: N6-[1-[(4-methoxyphenyl)methyl]-4-piperidinyl]-N2-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine IUPAC Name: 6-N-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-2-N-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Traditional Name: [2-(4-morpholinoanilino)-7H-purin-6-yl]-(1-p-anisyl-4-piperidyl)amine Formula: C28H34N8O2 MolecularWeight: 514.62196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCC(CC2)NC3=NC(=NC4=C3NC=N4)NC5=CC=C(C=C5)N6CCOCC6

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCC(CC2)NC3=NC(=NC4=C3NC=N4)NC5=CC=C(C=C5)N6CCOCC6

InChI

InChI=1S/C28H34N8O2/c1-37-24-8-2-20(3-9-24)18-35-12-10-22(11-13-35)31-27-25-26(30-19-29-25)33-28(34-27)32-21-4-6-23(7-5-21)36-14-16-38-17-15-36/h2-9,19,22H,10-18H2,1H3,(H3,29,30,31,32,33,34)