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

Systemtic Name: 7-(4-heptylphenyl)-2,4-dimethyl-6-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(4-heptylphenyl)-2,4-dimethyl-6-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(4-heptylphenyl)-2,4-dimethyl-6-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(4-heptylphenyl)-2,4-dimethyl-6-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(4-heptylphenyl)-2,4-dimethyl-6-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC=CC=C5)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC=CC=C5)N(C(=O)N(C4=O)C)C

InChI

InChI=1S/C28H31N5O2/c1-4-5-6-7-9-12-20-15-17-21(18-16-20)23-19-32-24-25(30(2)28(35)31(3)26(24)34)29-27(32)33(23)22-13-10-8-11-14-22/h8,10-11,13-19H,4-7,9,12H2,1-3H3