1-(4-bromophenyl)-2-(4-methylphenyl)-9-phenyl-purin-6-one

Systemtic Name: 1-(4-bromophenyl)-2-(4-methylphenyl)-9-phenyl-purin-6-one Openeye Name: 1-(4-bromophenyl)-9-phenyl-2-(p-tolyl)purin-6-one CAS Name: 1-(4-bromophenyl)-2-(4-methylphenyl)-9-phenyl-6-purinone IUPAC Name: 1-(4-bromophenyl)-2-(4-methylphenyl)-9-phenylpurin-6-one Traditional Name: 1-(4-bromophenyl)-9-phenyl-2-(p-tolyl)purin-6-one Formula: C24H17BrN4O MolecularWeight: 457.32198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)N=CN3C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)N=CN3C5=CC=CC=C5

InChI

InChI=1S/C24H17BrN4O/c1-16-7-9-17(10-8-16)22-27-23-21(26-15-28(23)19-5-3-2-4-6-19)24(30)29(22)20-13-11-18(25)12-14-20/h2-15H,1H3