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

Systemtic Name: 7-(4-bromophenyl)-6-(3-ethoxypropyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(4-bromophenyl)-6-(3-ethoxypropyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(4-bromophenyl)-6-(3-ethoxypropyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(4-bromophenyl)-6-(3-ethoxypropyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(4-bromophenyl)-6-(3-ethoxypropyl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H22BrN5O3 MolecularWeight: 460.32438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H22BrN5O3/c1-4-29-11-5-10-25-15(13-6-8-14(21)9-7-13)12-26-16-17(22-19(25)26)23(2)20(28)24(3)18(16)27/h6-9,12H,4-5,10-11H2,1-3H3