6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-methoxy-5-methylphenyl)-4,7-dimethyl-2-phenacylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-methoxy-5-methylphenyl)-4,7-dimethyl-2-phenacylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-2-phenacyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H23N5O4 MolecularWeight: 457.48122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C25H23N5O4/c1-15-10-11-20(34-4)18(12-15)30-16(2)13-28-21-22(26-24(28)30)27(3)25(33)29(23(21)32)14-19(31)17-8-6-5-7-9-17/h5-13H,14H2,1-4H3