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

Systemtic Name: 2,4-dimethyl-7-(4-methylphenyl)-6-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2,4-dimethyl-6-phenethyl-7-(p-tolyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 2,4-dimethyl-7-(4-methylphenyl)-6-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2,4-dimethyl-7-(4-methylphenyl)-6-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2,4-dimethyl-6-phenethyl-7-(p-tolyl)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=C(C=C1)C2=CN3C4=C(N=C3N2CCC5=CC=CC=C5)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2CCC5=CC=CC=C5)N(C(=O)N(C4=O)C)C

InChI

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