8-(4-chlorophenyl)-7-ethyl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-(4-chlorophenyl)-7-ethyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-(4-chlorophenyl)-7-ethyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(4-chlorophenyl)-7-ethyl-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-(4-chlorophenyl)-7-ethyl-1,3-dimethylpurine-2,6-dione Traditional Name: 8-(4-chlorophenyl)-7-ethyl-1,3-dimethyl-xanthine Formula: C15H15ClN4O2 MolecularWeight: 318.7582

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1C3=CC=C(C=C3)Cl)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1C3=CC=C(C=C3)Cl)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C15H15ClN4O2/c1-4-20-11-13(18(2)15(22)19(3)14(11)21)17-12(20)9-5-7-10(16)8-6-9/h5-8H,4H2,1-3H3