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

Systemtic Name: 6-(2-ethoxyphenyl)-4,7,8-trimethyl-2-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-ethoxyphenyl)-4,7,8-trimethyl-2-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-ethoxyphenyl)-4,7,8-trimethyl-2-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-ethoxyphenyl)-4,7,8-trimethyl-2-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7,8-trimethyl-6-o-phenetyl-2-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C26H27N5O3 MolecularWeight: 457.52428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=C(N3C2=NC4=C3C(=O)N(C(=O)N4C)CCC5=CC=CC=C5)C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=C(N3C2=NC4=C3C(=O)N(C(=O)N4C)CCC5=CC=CC=C5)C)C

InChI

InChI=1S/C26H27N5O3/c1-5-34-21-14-10-9-13-20(21)30-17(2)18(3)31-22-23(27-25(30)31)28(4)26(33)29(24(22)32)16-15-19-11-7-6-8-12-19/h6-14H,5,15-16H2,1-4H3