N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)thio]ethyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[2-[(3-keto-4H-1,4-benzothiazin-2-yl)thio]ethyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C17H15F3N2O4S3 MolecularWeight: 464.50221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(S2)SCCNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(S2)SCCNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C17H15F3N2O4S3/c18-17(19,20)26-11-5-7-12(8-6-11)29(24,25)21-9-10-27-16-15(23)22-13-3-1-2-4-14(13)28-16/h1-8,16,21H,9-10H2,(H,22,23)