N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-6,8-diamine

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-6,8-diamine Openeye Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-6,8-diamine CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-[3-(2-methoxyethoxy)propyl]purine-6,8-diamine IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[3-(2-methoxyethoxy)propyl]purine-6,8-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[3-(2-methoxyethoxy)propylamino]purin-8-yl]amine Formula: C22H37N7O2 MolecularWeight: 431.57488

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCCCNC1=NC=NC2=C1N=C(N2C3CCCC3)NC4CCC(CC4)N

Isomeric SMILES

COCCOCCCNC1=NC=NC2=C1N=C(N2C3CCCC3)NC4CCC(CC4)N

InChI

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