2-chloranyl-9-cyclopentyl-N-[2-(1-methoxyhexyl)piperidin-4-yl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[2-(1-methoxyhexyl)piperidin-4-yl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-[2-(1-methoxyhexyl)-4-piperidyl]purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[2-(1-methoxyhexyl)-4-piperidinyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[2-(1-methoxyhexyl)piperidin-4-yl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[2-(1-methoxyhexyl)-4-piperidyl]amine Formula: C22H35ClN6O MolecularWeight: 435.0059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl)OC

Isomeric SMILES

CCCCCC(C1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl)OC

InChI

InChI=1S/C22H35ClN6O/c1-3-4-5-10-18(30-2)17-13-15(11-12-24-17)26-20-19-21(28-22(23)27-20)29(14-25-19)16-8-6-7-9-16/h14-18,24H,3-13H2,1-2H3,(H,26,27,28)