N2-(4-azanylcyclohexyl)-N6-(4-butylpiperidin-1-yl)-9-cyclopentyl-purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-(4-butylpiperidin-1-yl)-9-cyclopentyl-purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-(4-butyl-1-piperidyl)-9-cyclopentyl-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-N6-(4-butyl-1-piperidinyl)-9-cyclopentylpurine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-(4-butylpiperidin-1-yl)-9-cyclopentylpurine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-[(4-butylpiperidino)amino]-9-cyclopentyl-purin-2-yl]amine Formula: C25H42N8 MolecularWeight: 454.65458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

CCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C25H42N8/c1-2-3-6-18-13-15-32(16-14-18)31-23-22-24(33(17-27-22)21-7-4-5-8-21)30-25(29-23)28-20-11-9-19(26)10-12-20/h17-21H,2-16,26H2,1H3,(H2,28,29,30,31)