7-[(2-chlorophenyl)methyl]-8-[(2,4-dichlorophenyl)methoxy]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(2-chlorophenyl)methyl]-8-[(2,4-dichlorophenyl)methoxy]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(2-chlorophenyl)methyl]-8-[(2,4-dichlorophenyl)methoxy]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(2-chlorophenyl)methyl]-8-[(2,4-dichlorophenyl)methoxy]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(2-chlorophenyl)methyl]-8-[(2,4-dichlorophenyl)methoxy]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-chlorobenzyl)-8-(2,4-dichlorobenzyl)oxy-1,3-dimethyl-xanthine Formula: C21H17Cl3N4O3 MolecularWeight: 479.74368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OCC3=C(C=C(C=C3)Cl)Cl)CC4=CC=CC=C4Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OCC3=C(C=C(C=C3)Cl)Cl)CC4=CC=CC=C4Cl

InChI

InChI=1S/C21H17Cl3N4O3/c1-26-18-17(19(29)27(2)21(26)30)28(10-12-5-3-4-6-15(12)23)20(25-18)31-11-13-7-8-14(22)9-16(13)24/h3-9H,10-11H2,1-2H3