2,2,3,3-tetrakis(fluoranyl)propyl 2-azanyl-1,3-benzothiazole-6-sulfonate

Systemtic Name: 2,2,3,3-tetrakis(fluoranyl)propyl 2-azanyl-1,3-benzothiazole-6-sulfonate Openeye Name: 2,2,3,3-tetrafluoropropyl 2-amino-1,3-benzothiazole-6-sulfonate CAS Name: 2-amino-1,3-benzothiazole-6-sulfonic acid 2,2,3,3-tetrafluoropropyl ester IUPAC Name: 2,2,3,3-tetrafluoropropyl 2-amino-1,3-benzothiazole-6-sulfonate Traditional Name: 2-amino-1,3-benzothiazole-6-sulfonic acid 2,2,3,3-tetrafluoropropyl ester Formula: C10H8F4N2O3S2 MolecularWeight: 344.305733

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)OCC(C(F)F)(F)F)SC(=N2)N

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)OCC(C(F)F)(F)F)SC(=N2)N

InChI

InChI=1S/C10H8F4N2O3S2/c11-8(12)10(13,14)4-19-21(17,18)5-1-2-6-7(3-5)20-9(15)16-6/h1-3,8H,4H2,(H2,15,16)