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

Systemtic Name: 4,7-dimethyl-6-(3-methylphenyl)-2-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7-dimethyl-6-(m-tolyl)-2-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-6-(3-methylphenyl)-2-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-6-(3-methylphenyl)-2-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7-dimethyl-6-(m-tolyl)-2-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCC5=CC=CC=C5)C

InChI

InChI=1S/C24H23N5O2/c1-16-8-7-11-19(14-16)29-17(2)15-28-20-21(25-23(28)29)26(3)24(31)27(22(20)30)13-12-18-9-5-4-6-10-18/h4-11,14-15H,12-13H2,1-3H3