N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-(3-morpholin-4-ylpropyl)purine-2,6-diamine dihydrochloride

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-(3-morpholin-4-ylpropyl)purine-2,6-diamine dihydrochloride Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-(3-morpholinopropyl)purine-2,6-diamine dihydrochloride CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(4-morpholinyl)propyl]purine-2,6-diamine dihydrochloride IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-(3-morpholin-4-ylpropyl)purine-2,6-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-(3-morpholinopropylamino)purin-2-yl]amine dihydrochloride Formula: C23H40Cl2N8O MolecularWeight: 515.5227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCCN4CCOCC4)NC5CCC(CC5)N.Cl.Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCCN4CCOCC4)NC5CCC(CC5)N.Cl.Cl

InChI

InChI=1S/C23H38N8O.2ClH/c24-17-6-8-18(9-7-17)27-23-28-21(25-10-3-11-30-12-14-32-15-13-30)20-22(29-23)31(16-26-20)19-4-1-2-5-19;;/h16-19H,1-15,24H2,(H2,25,27,28,29);2*1H