6-(1,3-benzodioxol-5-yl)-7-(4-ethoxyphenyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-7-(4-ethoxyphenyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(1,3-benzodioxol-5-yl)-7-(4-ethoxyphenyl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(1,3-benzodioxol-5-yl)-7-(4-ethoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(1,3-benzodioxol-5-yl)-7-(4-ethoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(1,3-benzodioxol-5-yl)-2,4-dimethyl-7-p-phenetyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H21N5O5 MolecularWeight: 459.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC6=C(C=C5)OCO6)N(C(=O)N(C4=O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC6=C(C=C5)OCO6)N(C(=O)N(C4=O)C)C

InChI

InChI=1S/C24H21N5O5/c1-4-32-16-8-5-14(6-9-16)17-12-28-20-21(26(2)24(31)27(3)22(20)30)25-23(28)29(17)15-7-10-18-19(11-15)34-13-33-18/h5-12H,4,13H2,1-3H3