2-chloranyl-9-cyclopentyl-N-[4-(5-phenylmethoxypentyl)piperidin-1-yl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[4-(5-phenylmethoxypentyl)piperidin-1-yl]purin-6-amine Openeye Name: N-[4-(5-benzyloxypentyl)-1-piperidyl]-2-chloro-9-cyclopentyl-purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[4-(5-phenylmethoxypentyl)-1-piperidinyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[4-(5-phenylmethoxypentyl)piperidin-1-yl]purin-6-amine Traditional Name: [4-(5-benzoxypentyl)piperidino]-(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=C3NN4CCC(CC4)CCCCCOCC5=CC=CC=C5)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CCCCCOCC5=CC=CC=C5)Cl

InChI

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