N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(1-methoxypropyl)piperidin-1-yl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(1-methoxypropyl)piperidin-1-yl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(1-methoxypropyl)-1-piperidyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(1-methoxypropyl)-1-piperidinyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(1-methoxypropyl)piperidin-1-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[4-(1-methoxypropyl)piperidino]amino]purin-2-yl]amine Formula: C25H42N8O MolecularWeight: 470.65398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N)OC

Isomeric SMILES

CCC(C1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N)OC

InChI

InChI=1S/C25H42N8O/c1-3-21(34-2)17-12-14-32(15-13-17)31-23-22-24(33(16-27-22)20-6-4-5-7-20)30-25(29-23)28-19-10-8-18(26)9-11-19/h16-21H,3-15,26H2,1-2H3,(H2,28,29,30,31)