N2-(4-azanylcyclohexyl)-9-(oxolan-3-yl)-N6-propyl-purine-2,6-diamine dihydrochloride

Systemtic Name: N2-(4-azanylcyclohexyl)-9-(oxolan-3-yl)-N6-propyl-purine-2,6-diamine dihydrochloride Openeye Name: N2-(4-aminocyclohexyl)-N6-propyl-9-tetrahydrofuran-3-yl-purine-2,6-diamine dihydrochloride CAS Name: N2-(4-aminocyclohexyl)-9-(3-oxolanyl)-N6-propylpurine-2,6-diamine dihydrochloride IUPAC Name: 2-N-(4-aminocyclohexyl)-9-(oxolan-3-yl)-6-N-propylpurine-2,6-diamine dihydrochloride Traditional Name: (4-aminocyclohexyl)-[6-(propylamino)-9-tetrahydrofuran-3-yl-purin-2-yl]amine dihydrochloride Formula: C18H31Cl2N7O MolecularWeight: 432.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC2=C1N=CN2C3CCOC3)NC4CCC(CC4)N.Cl.Cl

Isomeric SMILES

CCCNC1=NC(=NC2=C1N=CN2C3CCOC3)NC4CCC(CC4)N.Cl.Cl

InChI

InChI=1S/C18H29N7O.2ClH/c1-2-8-20-16-15-17(25(11-21-15)14-7-9-26-10-14)24-18(23-16)22-13-5-3-12(19)4-6-13;;/h11-14H,2-10,19H2,1H3,(H2,20,22,23,24);2*1H