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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

Isomeric SMILES

CCCCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

InChI

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