2-(2-ethoxyethyl)-6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-(2-ethoxyethyl)-6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-(2-ethoxyethyl)-6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-(2-ethoxyethyl)-6-(2-methoxy-5-methylphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-(2-ethoxyethyl)-6-(2-methoxy-5-methylphenyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(2-ethoxyethyl)-6-(2-methoxy-5-methyl-phenyl)-4,7-dimethyl-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=C(C=CC(=C4)C)OC)C)N(C1=O)C

Isomeric SMILES

CCOCCN1C(=O)C2=C(N=C3N2C=C(N3C4=C(C=CC(=C4)C)OC)C)N(C1=O)C

InChI

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