9-(4-chlorophenyl)-8-(2-fluorophenyl)-2-methyl-6-(4-methylpiperazin-1-yl)purine

Systemtic Name: 9-(4-chlorophenyl)-8-(2-fluorophenyl)-2-methyl-6-(4-methylpiperazin-1-yl)purine Openeye Name: 9-(4-chlorophenyl)-8-(2-fluorophenyl)-2-methyl-6-(4-methylpiperazin-1-yl)purine CAS Name: 9-(4-chlorophenyl)-8-(2-fluorophenyl)-2-methyl-6-(4-methyl-1-piperazinyl)purine IUPAC Name: 9-(4-chlorophenyl)-8-(2-fluorophenyl)-2-methyl-6-(4-methylpiperazin-1-yl)purine Traditional Name: 9-(4-chlorophenyl)-8-(2-fluorophenyl)-2-methyl-6-(4-methylpiperazino)purine Formula: C23H22ClFN6 MolecularWeight: 436.912383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCN(CC3)C)N=C(N2C4=CC=C(C=C4)Cl)C5=CC=CC=C5F

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCN(CC3)C)N=C(N2C4=CC=C(C=C4)Cl)C5=CC=CC=C5F

InChI

InChI=1S/C23H22ClFN6/c1-15-26-22(30-13-11-29(2)12-14-30)20-23(27-15)31(17-9-7-16(24)8-10-17)21(28-20)18-5-3-4-6-19(18)25/h3-10H,11-14H2,1-2H3