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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCN(CC1)NC2=C3C(=NC=N3)N=C(N2C4CCCC4)NC5CCC(CC5)N)O

Isomeric SMILES

CCCC(C1CCN(CC1)NC2=C3C(=NC=N3)N=C(N2C4CCCC4)NC5CCC(CC5)N)O

InChI

InChI=1S/C25H42N8O/c1-2-5-21(34)17-12-14-32(15-13-17)31-24-22-23(28-16-27-22)30-25(33(24)20-6-3-4-7-20)29-19-10-8-18(26)9-11-19/h16-21,31,34H,2-15,26H2,1H3,(H,27,28,29,30)