N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[3-(1H-imidazol-2-yl)propyl]purine-2,6-diamine dihydrochloride

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[3-(1H-imidazol-2-yl)propyl]purine-2,6-diamine dihydrochloride Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(1H-imidazol-2-yl)propyl]purine-2,6-diamine dihydrochloride CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(1H-imidazol-2-yl)propyl]purine-2,6-diamine dihydrochloride IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[3-(1H-imidazol-2-yl)propyl]purine-2,6-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[3-(1H-imidazol-2-yl)propylamino]purin-2-yl]amine dihydrochloride Formula: C22H35Cl2N9 MolecularWeight: 496.4796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCCC4=NC=CN4)NC5CCC(CC5)N.Cl.Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCCC4=NC=CN4)NC5CCC(CC5)N.Cl.Cl

InChI

InChI=1S/C22H33N9.2ClH/c23-15-7-9-16(10-8-15)28-22-29-20(26-11-3-6-18-24-12-13-25-18)19-21(30-22)31(14-27-19)17-4-1-2-5-17;;/h12-17H,1-11,23H2,(H,24,25)(H2,26,28,29,30);2*1H