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

Systemtic Name: 2-[2-[4-[[6-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-2-yl]amino]piperidin-1-yl]ethoxy]ethanol Openeye Name: 2-[2-[4-[[6-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-2-yl]amino]-1-piperidyl]ethoxy]ethanol CAS Name: 2-[2-[4-[[6-[(4-aminocyclohexyl)amino]-9-cyclopentyl-2-purinyl]amino]-1-piperidinyl]ethoxy]ethanol IUPAC Name: 2-[2-[4-[[6-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-2-yl]amino]piperidin-1-yl]ethoxy]ethanol Traditional Name: 2-[2-[4-[[6-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-2-yl]amino]piperidino]ethoxy]ethanol Formula: C25H42N8O2 MolecularWeight: 486.65338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCC(CC4)N)NC5CCN(CC5)CCOCCO

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCC(CC4)N)NC5CCN(CC5)CCOCCO

InChI

InChI=1S/C25H42N8O2/c26-18-5-7-19(8-6-18)28-23-22-24(33(17-27-22)21-3-1-2-4-21)31-25(30-23)29-20-9-11-32(12-10-20)13-15-35-16-14-34/h17-21,34H,1-16,26H2,(H2,28,29,30,31)