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

Systemtic Name: 7-(3-bromanylpropyl)-8-ethyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(3-bromopropyl)-8-ethyl-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(3-bromopropyl)-8-ethyl-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(3-bromopropyl)-8-ethyl-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(3-bromopropyl)-8-ethyl-1,3-dimethyl-xanthine Formula: C12H17BrN4O2 MolecularWeight: 329.19298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CCCBr)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCC1=NC2=C(N1CCCBr)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C12H17BrN4O2/c1-4-8-14-10-9(17(8)7-5-6-13)11(18)16(3)12(19)15(10)2/h4-7H2,1-3H3