N8-(4-azanylcyclohexyl)-N6-[4-(1-butoxybutyl)piperidin-1-yl]-9-cyclopentyl-purine-6,8-diamine

Systemtic Name: N8-(4-azanylcyclohexyl)-N6-[4-(1-butoxybutyl)piperidin-1-yl]-9-cyclopentyl-purine-6,8-diamine Openeye Name: N8-(4-aminocyclohexyl)-N6-[4-(1-butoxybutyl)-1-piperidyl]-9-cyclopentyl-purine-6,8-diamine CAS Name: N8-(4-aminocyclohexyl)-N6-[4-(1-butoxybutyl)-1-piperidinyl]-9-cyclopentylpurine-6,8-diamine IUPAC Name: 8-N-(4-aminocyclohexyl)-6-N-[4-(1-butoxybutyl)piperidin-1-yl]-9-cyclopentylpurine-6,8-diamine Traditional Name: (4-aminocyclohexyl)-[6-[[4-(1-butoxybutyl)piperidino]amino]-9-cyclopentyl-purin-8-yl]amine Formula: C29H50N8O MolecularWeight: 526.7603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(CCC)C1CCN(CC1)NC2=NC=NC3=C2N=C(N3C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

CCCCOC(CCC)C1CCN(CC1)NC2=NC=NC3=C2N=C(N3C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C29H50N8O/c1-3-5-19-38-25(8-4-2)21-15-17-36(18-16-21)35-27-26-28(32-20-31-27)37(24-9-6-7-10-24)29(34-26)33-23-13-11-22(30)12-14-23/h20-25H,3-19,30H2,1-2H3,(H,33,34)(H,31,32,35)