2-ethyl-9-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]purin-6-amine

Systemtic Name: 2-ethyl-9-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]purin-6-amine Openeye Name: 2-ethyl-9-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]purin-6-amine CAS Name: 2-ethyl-9-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-6-purinamine IUPAC Name: 2-ethyl-9-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]purin-6-amine Traditional Name: [2-ethyl-9-[3-[4-(4-fluorophenyl)piperazino]propyl]purin-6-yl]amine Formula: C20H26FN7 MolecularWeight: 383.465743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)N)N=CN2CCCN3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=NC2=C(C(=N1)N)N=CN2CCCN3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H26FN7/c1-2-17-24-19(22)18-20(25-17)28(14-23-18)9-3-8-26-10-12-27(13-11-26)16-6-4-15(21)5-7-16/h4-7,14H,2-3,8-13H2,1H3,(H2,22,24,25)