9-(2,4-dimethylphenyl)-6-[4-(4-fluorophenyl)piperazin-1-yl]purine

Systemtic Name: 9-(2,4-dimethylphenyl)-6-[4-(4-fluorophenyl)piperazin-1-yl]purine Openeye Name: 9-(2,4-dimethylphenyl)-6-[4-(4-fluorophenyl)piperazin-1-yl]purine CAS Name: 9-(2,4-dimethylphenyl)-6-[4-(4-fluorophenyl)-1-piperazinyl]purine IUPAC Name: 9-(2,4-dimethylphenyl)-6-[4-(4-fluorophenyl)piperazin-1-yl]purine Traditional Name: 9-(2,4-dimethylphenyl)-6-[4-(4-fluorophenyl)piperazino]purine Formula: C23H23FN6 MolecularWeight: 402.467323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=NC3=C2N=CN=C3N4CCN(CC4)C5=CC=C(C=C5)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=NC3=C2N=CN=C3N4CCN(CC4)C5=CC=C(C=C5)F)C

InChI

InChI=1S/C23H23FN6/c1-16-3-8-20(17(2)13-16)30-15-27-21-22(25-14-26-23(21)30)29-11-9-28(10-12-29)19-6-4-18(24)5-7-19/h3-8,13-15H,9-12H2,1-2H3