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

Systemtic Name: 7-(4-ethylphenyl)-6-(4-iodanyl-2-methyl-phenyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(4-ethylphenyl)-6-(4-iodo-2-methyl-phenyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(4-ethylphenyl)-6-(4-iodo-2-methylphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(4-ethylphenyl)-6-(4-iodo-2-methylphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(4-ethylphenyl)-6-(4-iodo-2-methyl-phenyl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H22IN5O2 MolecularWeight: 539.36825

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=C(C=C(C=C5)I)C)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=C(C=C(C=C5)I)C)N(C(=O)N(C4=O)C)C

InChI

InChI=1S/C24H22IN5O2/c1-5-15-6-8-16(9-7-15)19-13-29-20-21(27(3)24(32)28(4)22(20)31)26-23(29)30(19)18-11-10-17(25)12-14(18)2/h6-13H,5H2,1-4H3