8-bromanyl-1,3-dimethyl-7-propan-2-yl-purine-2,6-dione

Systemtic Name: 8-bromanyl-1,3-dimethyl-7-propan-2-yl-purine-2,6-dione Openeye Name: 8-bromo-7-isopropyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-bromo-1,3-dimethyl-7-propan-2-ylpurine-2,6-dione IUPAC Name: 8-bromo-1,3-dimethyl-7-propan-2-ylpurine-2,6-dione Traditional Name: 8-bromo-7-isopropyl-1,3-dimethyl-xanthine Formula: C10H13BrN4O2 MolecularWeight: 301.13982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(N=C1Br)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)N1C2=C(N=C1Br)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C10H13BrN4O2/c1-5(2)15-6-7(12-9(15)11)13(3)10(17)14(4)8(6)16/h5H,1-4H3