N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-(2-pyridin-2-ylethyl)purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-(2-pyridin-2-ylethyl)purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[2-(2-pyridyl)ethyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[2-(2-pyridinyl)ethyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-(2-pyridin-2-ylethyl)purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[2-(2-pyridyl)ethylamino]purin-2-yl]amine Formula: C23H32N8 MolecularWeight: 420.55378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CC=CC=N4)NC5CCC(CC5)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CC=CC=N4)NC5CCC(CC5)N

InChI

InChI=1S/C23H32N8/c24-16-8-10-18(11-9-16)28-23-29-21(26-14-12-17-5-3-4-13-25-17)20-22(30-23)31(15-27-20)19-6-1-2-7-19/h3-5,13,15-16,18-19H,1-2,6-12,14,24H2,(H2,26,28,29,30)