5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-methyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-methyl-1,2,3,4-tetrazole Openeye Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-methyl-tetrazole CAS Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1-methyltetrazole IUPAC Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-methyltetrazole Traditional Name: 5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1-methyl-tetrazole Formula: C11H11BrN4O2S MolecularWeight: 343.19964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CN1C(=NN=N1)SCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C11H11BrN4O2S/c1-16-11(13-14-15-16)19-6-7-4-9-10(5-8(7)12)18-3-2-17-9/h4-5H,2-3,6H2,1H3