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

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(6-phenylmethoxyhexyl)piperidin-1-yl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-[4-(6-benzyloxyhexyl)-1-piperidyl]-9-cyclopentyl-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(6-phenylmethoxyhexyl)-1-piperidinyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(6-phenylmethoxyhexyl)piperidin-1-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-[[4-(6-benzoxyhexyl)piperidino]amino]-9-cyclopentyl-purin-2-yl]amine Formula: C34H52N8O MolecularWeight: 588.82968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CCCCCCOCC5=CC=CC=C5)NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CCCCCCOCC5=CC=CC=C5)NC6CCC(CC6)N

InChI

InChI=1S/C34H52N8O/c35-28-15-17-29(18-16-28)37-34-38-32(31-33(39-34)42(25-36-31)30-13-7-8-14-30)40-41-21-19-26(20-22-41)10-4-1-2-9-23-43-24-27-11-5-3-6-12-27/h3,5-6,11-12,25-26,28-30H,1-2,4,7-10,13-24,35H2,(H2,37,38,39,40)