6-(4-butylphenyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(4-butylphenyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-butylphenyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-butylphenyl)-4-methyl-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-butylphenyl)-4-methyl-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-butylphenyl)-4-methyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H23N5O2 MolecularWeight: 413.47172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)NC(=O)N4C)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)NC(=O)N4C)C5=CC=CC=C5

InChI

InChI=1S/C24H23N5O2/c1-3-4-8-16-11-13-18(14-12-16)29-19(17-9-6-5-7-10-17)15-28-20-21(25-23(28)29)27(2)24(31)26-22(20)30/h5-7,9-15H,3-4,8H2,1-2H3,(H,26,30,31)