1-[2,3-bis(bromanyl)propyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-[2,3-bis(bromanyl)propyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-(2,3-dibromopropyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 1-(2,3-dibromopropyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-(2,3-dibromopropyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 1-(2,3-dibromopropyl)-3,7-dimethyl-xanthine Formula: C10H12Br2N4O2 MolecularWeight: 380.03588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(CBr)Br

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(CBr)Br

InChI

InChI=1S/C10H12Br2N4O2/c1-14-5-13-8-7(14)9(17)16(4-6(12)3-11)10(18)15(8)2/h5-6H,3-4H2,1-2H3