2-chloranyl-9-cyclopentyl-N-[2-(5-phenylmethoxypentyl)piperidin-4-yl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[2-(5-phenylmethoxypentyl)piperidin-4-yl]purin-6-amine Openeye Name: N-[2-(5-benzyloxypentyl)-4-piperidyl]-2-chloro-9-cyclopentyl-purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[2-(5-phenylmethoxypentyl)-4-piperidinyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[2-(5-phenylmethoxypentyl)piperidin-4-yl]purin-6-amine Traditional Name: [2-(5-benzoxypentyl)-4-piperidyl]-(2-chloro-9-cyclopentyl-purin-6-yl)amine Formula: C27H37ClN6O MolecularWeight: 497.07528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCNC(C4)CCCCCOCC5=CC=CC=C5)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4CCNC(C4)CCCCCOCC5=CC=CC=C5)Cl

InChI

InChI=1S/C27H37ClN6O/c28-27-32-25(24-26(33-27)34(19-30-24)23-12-6-7-13-23)31-22-14-15-29-21(17-22)11-5-2-8-16-35-18-20-9-3-1-4-10-20/h1,3-4,9-10,19,21-23,29H,2,5-8,11-18H2,(H,31,32,33)