4-methyl-6-(2-methylphenyl)-2-(2-methylprop-2-enyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-6-(2-methylphenyl)-2-(2-methylprop-2-enyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4-methyl-2-(2-methylallyl)-6-(o-tolyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-6-(2-methylphenyl)-2-(2-methylprop-2-enyl)-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-6-(2-methylphenyl)-2-(2-methylprop-2-enyl)-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4-methyl-2-(2-methylallyl)-6-(o-tolyl)-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H23N5O2 MolecularWeight: 425.48242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=C)C)C5=CC=CC=C5

InChI

InChI=1S/C25H23N5O2/c1-16(2)14-29-23(31)21-22(27(4)25(29)32)26-24-28(21)15-20(18-11-6-5-7-12-18)30(24)19-13-9-8-10-17(19)3/h5-13,15H,1,14H2,2-4H3