N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(5-propoxypentyl)piperidin-1-yl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(5-propoxypentyl)piperidin-1-yl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(5-propoxypentyl)-1-piperidyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(5-propoxypentyl)-1-piperidinyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(5-propoxypentyl)piperidin-1-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[4-(5-propoxypentyl)piperidino]amino]purin-2-yl]amine Formula: C29H50N8O MolecularWeight: 526.7603

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

CCCOCCCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C29H50N8O/c1-2-19-38-20-7-3-4-8-22-15-17-36(18-16-22)35-27-26-28(37(21-31-26)25-9-5-6-10-25)34-29(33-27)32-24-13-11-23(30)12-14-24/h21-25H,2-20,30H2,1H3,(H2,32,33,34,35)