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

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-phenyl-purine-6,8-diamine dihydrochloride Openeye Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-phenyl-purine-6,8-diamine dihydrochloride CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-phenylpurine-6,8-diamine dihydrochloride IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-phenylpurine-6,8-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-(6-anilino-9-cyclopentyl-purin-8-yl)amine dihydrochloride Formula: C22H31Cl2N7 MolecularWeight: 464.43444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=NC=N3)NC4=CC=CC=C4)N=C2NC5CCC(CC5)N.Cl.Cl

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=NC=N3)NC4=CC=CC=C4)N=C2NC5CCC(CC5)N.Cl.Cl

InChI

InChI=1S/C22H29N7.2ClH/c23-15-10-12-17(13-11-15)27-22-28-19-20(26-16-6-2-1-3-7-16)24-14-25-21(19)29(22)18-8-4-5-9-18;;/h1-3,6-7,14-15,17-18H,4-5,8-13,23H2,(H,27,28)(H,24,25,26);2*1H