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

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[1-[3-(dimethylamino)propyl]piperidin-4-yl]purine-2,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[1-[3-(dimethylamino)propyl]-4-piperidyl]purine-2,6-diamine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[1-[3-(dimethylamino)propyl]-4-piperidinyl]purine-2,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-[1-[3-(dimethylamino)propyl]piperidin-4-yl]purine-2,6-diamine Traditional Name: 3-[4-[[6-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-2-yl]amino]piperidino]propyl-dimethyl-amine Formula: C26H45N9 MolecularWeight: 483.6958

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1CCC(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

Isomeric SMILES

CN(C)CCCN1CCC(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

InChI

InChI=1S/C26H45N9/c1-33(2)14-5-15-34-16-12-21(13-17-34)30-26-31-24(29-20-10-8-19(27)9-11-20)23-25(32-26)35(18-28-23)22-6-3-4-7-22/h18-22H,3-17,27H2,1-2H3,(H2,29,30,31,32)