8-bromanyl-9-[(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-bromanyl-9-[(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-bromo-9-[(5-chlorothiadiazol-4-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-bromo-9-[(5-chloro-4-thiadiazolyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-bromo-9-[(5-chlorothiadiazol-4-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-bromo-9-[(5-chlorothiadiazol-4-yl)methyl]-1,3-dimethyl-xanthine Formula: C10H8BrClN6O2S MolecularWeight: 391.63152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC3=C(SN=N3)Cl)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC3=C(SN=N3)Cl)Br

InChI

InChI=1S/C10H8BrClN6O2S/c1-16-7-5(8(19)17(2)10(16)20)13-9(11)18(7)3-4-6(12)21-15-14-4/h3H2,1-2H3