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

Systemtic Name: 2-chloranyl-N-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-yl]-9-cyclopentyl-purin-6-amine Openeye Name: 2-chloro-N-[4-[(2-chloro-6-fluoro-phenyl)methyl]-1-piperidyl]-9-cyclopentyl-purin-6-amine CAS Name: 2-chloro-N-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperidinyl]-9-cyclopentyl-6-purinamine IUPAC Name: 2-chloro-N-[4-[(2-chloro-6-fluorophenyl)methyl]piperidin-1-yl]-9-cyclopentylpurin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[4-(2-chloro-6-fluoro-benzyl)piperidino]amine Formula: C22H25Cl2FN6 MolecularWeight: 463.378503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5=C(C=CC=C5Cl)F)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5=C(C=CC=C5Cl)F)Cl

InChI

InChI=1S/C22H25Cl2FN6/c23-17-6-3-7-18(25)16(17)12-14-8-10-30(11-9-14)29-20-19-21(28-22(24)27-20)31(13-26-19)15-4-1-2-5-15/h3,6-7,13-15H,1-2,4-5,8-12H2,(H,27,28,29)