6-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methyl]-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methyl]-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methyl]-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methyl]-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methyl]-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(4-fluorobenzyl)-4,7-dimethyl-6-p-phenetyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H22FN5O3 MolecularWeight: 447.461583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=C(C=C5)F)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=C(C=C5)F)C

InChI

InChI=1S/C24H22FN5O3/c1-4-33-19-11-9-18(10-12-19)30-15(2)13-28-20-21(26-23(28)30)27(3)24(32)29(22(20)31)14-16-5-7-17(25)8-6-16/h5-13H,4,14H2,1-3H3