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

Systemtic Name: 2-(2-ethoxyethyl)-6-(2-ethoxyphenyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-(2-ethoxyethyl)-6-(2-ethoxyphenyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-(2-ethoxyethyl)-6-(2-ethoxyphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-(2-ethoxyethyl)-6-(2-ethoxyphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(2-ethoxyethyl)-4,7-dimethyl-6-o-phenetyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=CC=C4OCC)C)N(C1=O)C

Isomeric SMILES

CCOCCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=CC=C4OCC)C)N(C1=O)C

InChI

InChI=1S/C21H25N5O4/c1-5-29-12-11-24-19(27)17-18(23(4)21(24)28)22-20-25(17)13-14(3)26(20)15-9-7-8-10-16(15)30-6-2/h7-10,13H,5-6,11-12H2,1-4H3