N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[3-(2-methoxyethoxy)propyl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[3-(2-methoxyethoxy)propylamino]purin-2-yl]amine Formula: C22H37N7O2 MolecularWeight: 431.57488

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCCCNC1=NC(=NC2=C1N=CN2C3CCCC3)NC4CCC(CC4)N

Isomeric SMILES

COCCOCCCNC1=NC(=NC2=C1N=CN2C3CCCC3)NC4CCC(CC4)N

InChI

InChI=1S/C22H37N7O2/c1-30-13-14-31-12-4-11-24-20-19-21(29(15-25-19)18-5-2-3-6-18)28-22(27-20)26-17-9-7-16(23)8-10-17/h15-18H,2-14,23H2,1H3,(H2,24,26,27,28)