5-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-1-methyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-1-methyl-1,2,3,4-tetrazole Openeye Name: 5-[(4-bromo-2,5-dimethoxy-phenyl)methylsulfanyl]-1-methyl-tetrazole CAS Name: 5-[(4-bromo-2,5-dimethoxyphenyl)methylthio]-1-methyltetrazole IUPAC Name: 5-[(4-bromo-2,5-dimethoxyphenyl)methylsulfanyl]-1-methyltetrazole Traditional Name: 5-[(4-bromo-2,5-dimethoxy-benzyl)thio]-1-methyl-tetrazole Formula: C11H13BrN4O2S MolecularWeight: 345.21552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=CC(=C(C=C2OC)Br)OC

Isomeric SMILES

CN1C(=NN=N1)SCC2=CC(=C(C=C2OC)Br)OC

InChI

InChI=1S/C11H13BrN4O2S/c1-16-11(13-14-15-16)19-6-7-4-10(18-3)8(12)5-9(7)17-2/h4-5H,6H2,1-3H3