8-bromanyl-1-(3-chloranylpropyl)-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-bromanyl-1-(3-chloranylpropyl)-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-bromo-1-(3-chloropropyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 8-bromo-1-(3-chloropropyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-bromo-1-(3-chloropropyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 8-bromo-1-(3-chloropropyl)-3,7-dimethyl-xanthine Formula: C10H12BrClN4O2 MolecularWeight: 335.58488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1Br)N(C(=O)N(C2=O)CCCCl)C

Isomeric SMILES

CN1C2=C(N=C1Br)N(C(=O)N(C2=O)CCCCl)C

InChI

InChI=1S/C10H12BrClN4O2/c1-14-6-7(13-9(14)11)15(2)10(18)16(8(6)17)5-3-4-12/h3-5H2,1-2H3