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

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[4-(5-methoxypentyl)piperidin-1-yl]purine-2,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[4-(5-methoxypentyl)-1-piperidyl]purine-2,6-diamine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[4-(5-methoxypentyl)-1-piperidinyl]purine-2,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-[4-(5-methoxypentyl)piperidin-1-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-2-[[4-(5-methoxypentyl)piperidino]amino]purin-6-yl]amine Formula: C27H46N8O MolecularWeight: 498.70714

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

Isomeric SMILES

COCCCCCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

InChI

InChI=1S/C27H46N8O/c1-36-18-6-2-3-7-20-14-16-34(17-15-20)33-27-31-25(30-22-12-10-21(28)11-13-22)24-26(32-27)35(19-29-24)23-8-4-5-9-23/h19-23H,2-18,28H2,1H3,(H2,30,31,32,33)