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

Systemtic Name: 2,4,8-trimethyl-7-(4-methylphenyl)-6-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2,4,8-trimethyl-6-phenethyl-7-(p-tolyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 2,4,8-trimethyl-7-(4-methylphenyl)-6-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2,4,8-trimethyl-7-(4-methylphenyl)-6-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2,4,8-trimethyl-6-phenethyl-7-(p-tolyl)purin[7,8-a]imidazole-1,3-quinone Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N3C4=C(N=C3N2CCC5=CC=CC=C5)N(C(=O)N(C4=O)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N3C4=C(N=C3N2CCC5=CC=CC=C5)N(C(=O)N(C4=O)C)C)C

InChI

InChI=1S/C25H25N5O2/c1-16-10-12-19(13-11-16)20-17(2)30-21-22(27(3)25(32)28(4)23(21)31)26-24(30)29(20)15-14-18-8-6-5-7-9-18/h5-13H,14-15H2,1-4H3