9-cyclopentyl-N-[2-[(3-fluorophenyl)methyl]piperidin-1-yl]purin-2-amine

Systemtic Name: 9-cyclopentyl-N-[2-[(3-fluorophenyl)methyl]piperidin-1-yl]purin-2-amine Openeye Name: 9-cyclopentyl-N-[2-[(3-fluorophenyl)methyl]-1-piperidyl]purin-2-amine CAS Name: 9-cyclopentyl-N-[2-[(3-fluorophenyl)methyl]-1-piperidinyl]-2-purinamine IUPAC Name: 9-cyclopentyl-N-[2-[(3-fluorophenyl)methyl]piperidin-1-yl]purin-2-amine Traditional Name: (9-cyclopentylpurin-2-yl)-[2-(3-fluorobenzyl)piperidino]amine Formula: C22H27FN6 MolecularWeight: 394.488383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=CN=C(N=C32)NN4CCCCC4CC5=CC(=CC=C5)F

Isomeric SMILES

C1CCC(C1)N2C=NC3=CN=C(N=C32)NN4CCCCC4CC5=CC(=CC=C5)F

InChI

InChI=1S/C22H27FN6/c23-17-7-5-6-16(12-17)13-19-10-3-4-11-29(19)27-22-24-14-20-21(26-22)28(15-25-20)18-8-1-2-9-18/h5-7,12,14-15,18-19H,1-4,8-11,13H2,(H,24,26,27)