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

Systemtic Name: 7-(4-methoxyphenyl)-2,4-dimethyl-6-(2-methylphenyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(4-methoxyphenyl)-2,4-dimethyl-6-(o-tolyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(4-methoxyphenyl)-2,4-dimethyl-6-(2-methylphenyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(4-methoxyphenyl)-2,4-dimethyl-6-(2-methylphenyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(4-methoxyphenyl)-2,4-dimethyl-6-(o-tolyl)purin[7,8-a]imidazole-1,3-quinone Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O3/c1-14-7-5-6-8-17(14)28-18(15-9-11-16(31-4)12-10-15)13-27-19-20(24-22(27)28)25(2)23(30)26(3)21(19)29/h5-13H,1-4H3