N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[1-(2-naphthylmethyl)-4-piperidyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[1-(2-naphthalenylmethyl)-4-piperidinyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[1-(2-naphthylmethyl)-4-piperidyl]amino]purin-2-yl]amine Formula: C32H42N8 MolecularWeight: 538.72948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCN(CC4)CC5=CC6=CC=CC=C6C=C5)NC7CCC(CC7)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCN(CC4)CC5=CC6=CC=CC=C6C=C5)NC7CCC(CC7)N

InChI

InChI=1S/C32H42N8/c33-25-11-13-26(14-12-25)36-32-37-30(29-31(38-32)40(21-34-29)28-7-3-4-8-28)35-27-15-17-39(18-16-27)20-22-9-10-23-5-1-2-6-24(23)19-22/h1-2,5-6,9-10,19,21,25-28H,3-4,7-8,11-18,20,33H2,(H2,35,36,37,38)