(2-sulfamoyl-1,3-benzothiazol-6-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2-sulfamoyl-1,3-benzothiazol-6-yl) tris(fluoranyl)methanesulfonate Openeye Name: (2-sulfamoyl-1,3-benzothiazol-6-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2-sulfamoyl-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-sulfamoyl-1,3-benzothiazol-6-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2-sulfamoyl-1,3-benzothiazol-6-yl) ester Formula: C8H5F3N2O5S3 MolecularWeight: 362.32591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OS(=O)(=O)C(F)(F)F)SC(=N2)S(=O)(=O)N

Isomeric SMILES

C1=CC2=C(C=C1OS(=O)(=O)C(F)(F)F)SC(=N2)S(=O)(=O)N

InChI

InChI=1S/C8H5F3N2O5S3/c9-8(10,11)21(16,17)18-4-1-2-5-6(3-4)19-7(13-5)20(12,14)15/h1-3H,(H2,12,14,15)