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

Systemtic Name: 7-(3-chloranyl-4-ethoxy-phenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(3-chloro-4-ethoxy-phenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(3-chloro-4-ethoxyphenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(3-chloro-4-ethoxyphenyl)-6-[(2-chlorophenyl)methyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-chlorobenzyl)-7-(3-chloro-4-ethoxy-phenyl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H21Cl2N5O3 MolecularWeight: 498.36124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=CN3C4=C(N=C3N2CC5=CC=CC=C5Cl)N(C(=O)N(C4=O)C)C)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=CN3C4=C(N=C3N2CC5=CC=CC=C5Cl)N(C(=O)N(C4=O)C)C)Cl

InChI

InChI=1S/C24H21Cl2N5O3/c1-4-34-19-10-9-14(11-17(19)26)18-13-31-20-21(28(2)24(33)29(3)22(20)32)27-23(31)30(18)12-15-7-5-6-8-16(15)25/h5-11,13H,4,12H2,1-3H3