N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-dodecyl-purine-2,6-diamine dihydrochloride

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-dodecyl-purine-2,6-diamine dihydrochloride Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-dodecyl-purine-2,6-diamine dihydrochloride CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-dodecylpurine-2,6-diamine dihydrochloride IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-dodecylpurine-2,6-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-(laurylamino)purin-2-yl]amine dihydrochloride Formula: C28H51Cl2N7 MolecularWeight: 556.65744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=NC(=NC2=C1N=CN2C3CCCC3)NC4CCC(CC4)N.Cl.Cl

Isomeric SMILES

CCCCCCCCCCCCNC1=NC(=NC2=C1N=CN2C3CCCC3)NC4CCC(CC4)N.Cl.Cl

InChI

InChI=1S/C28H49N7.2ClH/c1-2-3-4-5-6-7-8-9-10-13-20-30-26-25-27(35(21-31-25)24-14-11-12-15-24)34-28(33-26)32-23-18-16-22(29)17-19-23;;/h21-24H,2-20,29H2,1H3,(H2,30,32,33,34);2*1H