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

Systemtic Name: 6-[(4-bromophenyl)methyl]-2,4,7-trimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-[(4-bromophenyl)methyl]-2,4,7-trimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-[(4-bromophenyl)methyl]-2,4,7-trimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-[(4-bromophenyl)methyl]-2,4,7-trimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-bromobenzyl)-2,4,7-trimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C17H16BrN5O2 MolecularWeight: 402.24524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CC4=CC=C(C=C4)Br)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CC4=CC=C(C=C4)Br)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C17H16BrN5O2/c1-10-8-23-13-14(20(2)17(25)21(3)15(13)24)19-16(23)22(10)9-11-4-6-12(18)7-5-11/h4-8H,9H2,1-3H3