9-(4-chlorophenyl)-6-[4-(2,5-dimethylphenyl)piperazin-1-yl]purine

Systemtic Name: 9-(4-chlorophenyl)-6-[4-(2,5-dimethylphenyl)piperazin-1-yl]purine Openeye Name: 9-(4-chlorophenyl)-6-[4-(2,5-dimethylphenyl)piperazin-1-yl]purine CAS Name: 9-(4-chlorophenyl)-6-[4-(2,5-dimethylphenyl)-1-piperazinyl]purine IUPAC Name: 9-(4-chlorophenyl)-6-[4-(2,5-dimethylphenyl)piperazin-1-yl]purine Traditional Name: 9-(4-chlorophenyl)-6-[4-(2,5-dimethylphenyl)piperazino]purine Formula: C23H23ClN6 MolecularWeight: 418.92192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=NC=NC4=C3N=CN4C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=NC=NC4=C3N=CN4C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H23ClN6/c1-16-3-4-17(2)20(13-16)28-9-11-29(12-10-28)22-21-23(26-14-25-22)30(15-27-21)19-7-5-18(24)6-8-19/h3-8,13-15H,9-12H2,1-2H3