7-(4-bromophenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 7-(4-bromophenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(4-bromophenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(4-bromophenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(4-bromophenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(4-bromophenyl)-6-(2-chlorobenzyl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C22H17BrClN5O2 MolecularWeight: 498.75968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC=CC=C4Cl)C5=CC=C(C=C5)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC=CC=C4Cl)C5=CC=C(C=C5)Br

InChI

InChI=1S/C22H17BrClN5O2/c1-26-19-18(20(30)27(2)22(26)31)29-12-17(13-7-9-15(23)10-8-13)28(21(29)25-19)11-14-5-3-4-6-16(14)24/h3-10,12H,11H2,1-2H3