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

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[2-(1-phenylmethoxyhexyl)piperidin-4-yl]purine-2,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-N2-[2-(1-benzyloxyhexyl)-4-piperidyl]-9-cyclopentyl-purine-2,6-diamine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[2-(1-phenylmethoxyhexyl)-4-piperidinyl]purine-2,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-[2-(1-phenylmethoxyhexyl)piperidin-4-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[2-[[2-(1-benzoxyhexyl)-4-piperidyl]amino]-9-cyclopentyl-purin-6-yl]amine Formula: C34H52N8O MolecularWeight: 588.82968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1CC(CCN1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5)OCC6=CC=CC=C6

Isomeric SMILES

CCCCCC(C1CC(CCN1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5)OCC6=CC=CC=C6

InChI

InChI=1S/C34H52N8O/c1-2-3-5-14-30(43-22-24-10-6-4-7-11-24)29-21-27(19-20-36-29)39-34-40-32(38-26-17-15-25(35)16-18-26)31-33(41-34)42(23-37-31)28-12-8-9-13-28/h4,6-7,10-11,23,25-30,36H,2-3,5,8-9,12-22,35H2,1H3,(H2,38,39,40,41)