6-[4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]hexan-1-ol

Systemtic Name: 6-[4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]hexan-1-ol Openeye Name: 6-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]-1-piperidyl]hexan-1-ol CAS Name: 6-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-1-piperidinyl]-1-hexanol IUPAC Name: 6-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]piperidin-1-yl]hexan-1-ol Traditional Name: 6-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidino]hexan-1-ol Formula: C27H46N8O MolecularWeight: 498.70714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCN(CC4)CCCCCCO)NC5CCC(CC5)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCN(CC4)CCCCCCO)NC5CCC(CC5)N

InChI

InChI=1S/C27H46N8O/c28-20-9-11-21(12-10-20)31-27-32-25(24-26(33-27)35(19-29-24)23-7-3-4-8-23)30-22-13-16-34(17-14-22)15-5-1-2-6-18-36/h19-23,36H,1-18,28H2,(H2,30,31,32,33)