9-[(4-fluorophenyl)methyl]-8-[[1-(phenylmethyl)piperidin-4-yl]methyl]purine

Systemtic Name: 9-[(4-fluorophenyl)methyl]-8-[[1-(phenylmethyl)piperidin-4-yl]methyl]purine Openeye Name: 8-[(1-benzyl-4-piperidyl)methyl]-9-[(4-fluorophenyl)methyl]purine CAS Name: 9-[(4-fluorophenyl)methyl]-8-[[1-(phenylmethyl)-4-piperidinyl]methyl]purine IUPAC Name: 8-[(1-benzylpiperidin-4-yl)methyl]-9-[(4-fluorophenyl)methyl]purine Traditional Name: 8-[(1-benzyl-4-piperidyl)methyl]-9-(4-fluorobenzyl)purine Formula: C25H26FN5 MolecularWeight: 415.505843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)F)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CC2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)F)CC5=CC=CC=C5

InChI

InChI=1S/C25H26FN5/c26-22-8-6-21(7-9-22)17-31-24(29-23-15-27-18-28-25(23)31)14-19-10-12-30(13-11-19)16-20-4-2-1-3-5-20/h1-9,15,18-19H,10-14,16-17H2