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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N)O

Isomeric SMILES

CCCCCC(C1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N)O

InChI

InChI=1S/C27H46N8O/c1-2-3-4-9-23(36)19-14-16-34(17-15-19)33-25-24-26(35(18-29-24)22-7-5-6-8-22)32-27(31-25)30-21-12-10-20(28)11-13-21/h18-23,36H,2-17,28H2,1H3,(H2,30,31,32,33)