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

Systemtic Name: 2-chloranyl-N-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperidin-1-yl]-9-cyclopentyl-purin-6-amine Openeye Name: 2-chloro-N-[4-[(2-chloro-4-fluoro-phenyl)methyl]-1-piperidyl]-9-cyclopentyl-purin-6-amine CAS Name: 2-chloro-N-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperidinyl]-9-cyclopentyl-6-purinamine IUPAC Name: 2-chloro-N-[4-[(2-chloro-4-fluorophenyl)methyl]piperidin-1-yl]-9-cyclopentylpurin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[4-(2-chloro-4-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=C(C=C5)F)Cl)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5=C(C=C(C=C5)F)Cl)Cl

InChI

InChI=1S/C22H25Cl2FN6/c23-18-12-16(25)6-5-15(18)11-14-7-9-30(10-8-14)29-20-19-21(28-22(24)27-20)31(13-26-19)17-3-1-2-4-17/h5-6,12-14,17H,1-4,7-11H2,(H,27,28,29)