8-bromanyl-7-[(2S)-2-bromanylpropyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-bromanyl-7-[(2S)-2-bromanylpropyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-bromo-7-[(2S)-2-bromopropyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-bromo-7-[(2S)-2-bromopropyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-bromo-7-[(2S)-2-bromopropyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-bromo-7-[(2S)-2-bromopropyl]-1,3-dimethyl-xanthine Formula: C10H12Br2N4O2 MolecularWeight: 380.03588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(N=C1Br)N(C(=O)N(C2=O)C)C)Br

Isomeric SMILES

C[C@@H](CN1C2=C(N=C1Br)N(C(=O)N(C2=O)C)C)Br

InChI

InChI=1S/C10H12Br2N4O2/c1-5(11)4-16-6-7(13-9(16)12)14(2)10(18)15(3)8(6)17/h5H,4H2,1-3H3/t5-/m0/s1