8-(4-fluorophenyl)-6-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]-2-methyl-9-propyl-purine

Systemtic Name: 8-(4-fluorophenyl)-6-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]-2-methyl-9-propyl-purine Openeye Name: 8-(4-fluorophenyl)-6-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]-2-methyl-9-propyl-purine CAS Name: 8-(4-fluorophenyl)-6-[4-[2-(1-imidazolyl)ethyl]-1-piperazinyl]-2-methyl-9-propylpurine IUPAC Name: 8-(4-fluorophenyl)-6-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]-2-methyl-9-propylpurine Traditional Name: 8-(4-fluorophenyl)-6-[4-(2-imidazol-1-ylethyl)piperazino]-2-methyl-9-propyl-purine Formula: C24H29FN8 MolecularWeight: 448.539063

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C)N3CCN(CC3)CCN4C=CN=C4)N=C1C5=CC=C(C=C5)F

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C)N3CCN(CC3)CCN4C=CN=C4)N=C1C5=CC=C(C=C5)F

InChI

InChI=1S/C24H29FN8/c1-3-9-33-22(19-4-6-20(25)7-5-19)29-21-23(27-18(2)28-24(21)33)32-15-13-30(14-16-32)11-12-31-10-8-26-17-31/h4-8,10,17H,3,9,11-16H2,1-2H3