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

Systemtic Name: 4-[4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]butan-1-ol Openeye Name: 4-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]-1-piperidyl]butan-1-ol CAS Name: 4-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-1-piperidinyl]-1-butanol IUPAC Name: 4-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]piperidin-1-yl]butan-1-ol Traditional Name: 4-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidino]butan-1-ol Formula: C25H42N8O MolecularWeight: 470.65398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H42N8O/c26-18-7-9-19(10-8-18)29-25-30-23(28-20-11-14-32(15-12-20)13-3-4-16-34)22-24(31-25)33(17-27-22)21-5-1-2-6-21/h17-21,34H,1-16,26H2,(H2,28,29,30,31)