N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-hexyl-purine-6,8-diamine dihydrochloride

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-hexyl-purine-6,8-diamine dihydrochloride Openeye Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-hexyl-purine-6,8-diamine dihydrochloride CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-hexylpurine-6,8-diamine dihydrochloride IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-hexylpurine-6,8-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-(hexylamino)purin-8-yl]amine dihydrochloride Formula: C22H39Cl2N7 MolecularWeight: 472.49796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC=NC2=C1N=C(N2C3CCCC3)NC4CCC(CC4)N.Cl.Cl

Isomeric SMILES

CCCCCCNC1=NC=NC2=C1N=C(N2C3CCCC3)NC4CCC(CC4)N.Cl.Cl

InChI

InChI=1S/C22H37N7.2ClH/c1-2-3-4-7-14-24-20-19-21(26-15-25-20)29(18-8-5-6-9-18)22(28-19)27-17-12-10-16(23)11-13-17;;/h15-18H,2-14,23H2,1H3,(H,27,28)(H,24,25,26);2*1H