(4-bromophenyl)sulfonyl-(4,5,6,7-tetrahydro-1,2-benzothiazol-2-ium-2-yl)azanide

Systemtic Name: (4-bromophenyl)sulfonyl-(4,5,6,7-tetrahydro-1,2-benzothiazol-2-ium-2-yl)azanide Openeye Name: (4-bromophenyl)sulfonyl-(4,5,6,7-tetrahydro-1,2-benzothiazol-2-ium-2-yl)azanide CAS Name: (4-bromophenyl)sulfonyl-(4,5,6,7-tetrahydro-1,2-benzothiazol-2-ium-2-yl)azanide IUPAC Name: (4-bromophenyl)sulfonyl-(4,5,6,7-tetrahydro-1,2-benzothiazol-2-ium-2-yl)azanide Traditional Name: brosyl(4,5,6,7-tetrahydro-1,2-benzothiazol-2-ium-2-yl)azanide Formula: C13H13BrN2O2S2 MolecularWeight: 373.28852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=[N+](S2)[N-]S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC2=C(C1)C=[N+](S2)[N-]S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H13BrN2O2S2/c14-11-5-7-12(8-6-11)20(17,18)15-16-9-10-3-1-2-4-13(10)19-16/h5-9H,1-4H2