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

Systemtic Name: 4,7-dimethyl-6-(3-methylphenyl)-2-phenacyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7-dimethyl-6-(m-tolyl)-2-phenacyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-6-(3-methylphenyl)-2-phenacylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-6-(3-methylphenyl)-2-phenacylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7-dimethyl-6-(m-tolyl)-2-phenacyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N5O3/c1-15-8-7-11-18(12-15)29-16(2)13-27-20-21(25-23(27)29)26(3)24(32)28(22(20)31)14-19(30)17-9-5-4-6-10-17/h4-13H,14H2,1-3H3