3-[4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]propan-1-ol

Systemtic Name: 3-[4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]propan-1-ol Openeye Name: 3-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]-1-piperidyl]propan-1-ol CAS Name: 3-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-1-piperidinyl]-1-propanol IUPAC Name: 3-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]piperidin-1-yl]propan-1-ol Traditional Name: 3-[4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidino]propan-1-ol Formula: C24H40N8O MolecularWeight: 456.6274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H40N8O/c25-17-6-8-18(9-7-17)28-24-29-22(27-19-10-13-31(14-11-19)12-3-15-33)21-23(30-24)32(16-26-21)20-4-1-2-5-20/h16-20,33H,1-15,25H2,(H2,27,28,29,30)