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

Systemtic Name: 3-bromanyl-N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide Openeye Name: 3-bromo-N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide CAS Name: 3-bromo-N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)thio]ethyl]benzenesulfonamide IUPAC Name: 3-bromo-N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide Traditional Name: 3-bromo-N-[2-[(3-keto-4H-1,4-benzothiazin-2-yl)thio]ethyl]benzenesulfonamide Formula: C16H15BrN2O3S3 MolecularWeight: 459.4009

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O3S3/c17-11-4-3-5-12(10-11)25(21,22)18-8-9-23-16-15(20)19-13-6-1-2-7-14(13)24-16/h1-7,10,16,18H,8-9H2,(H,19,20)