6-(2-ethoxyphenyl)-4-methyl-2-(3-oxidanylidenebutan-2-yl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(2-ethoxyphenyl)-4-methyl-2-(3-oxidanylidenebutan-2-yl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-ethoxyphenyl)-4-methyl-2-(1-methyl-2-oxo-propyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-ethoxyphenyl)-4-methyl-2-(3-oxobutan-2-yl)-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-ethoxyphenyl)-4-methyl-2-(3-oxobutan-2-yl)-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(2-keto-1-methyl-propyl)-4-methyl-6-o-phenetyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C26H25N5O4 MolecularWeight: 471.5078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C(C)C(=O)C)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C(C)C(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5O4/c1-5-35-21-14-10-9-13-19(21)31-20(18-11-7-6-8-12-18)15-29-22-23(27-25(29)31)28(4)26(34)30(24(22)33)16(2)17(3)32/h6-16H,5H2,1-4H3