N-(4-bromanyl-3-methyl-phenyl)-3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide CAS Name: N-(4-bromo-3-methylphenyl)-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-[(3-keto-4H-1,4-benzothiazin-6-yl)sulfonyl]butyramide Formula: C19H19BrN2O4S2 MolecularWeight: 483.39916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CC(C)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CC(C)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3)Br

InChI

InChI=1S/C19H19BrN2O4S2/c1-11-7-13(3-5-15(11)20)21-18(23)8-12(2)28(25,26)14-4-6-17-16(9-14)22-19(24)10-27-17/h3-7,9,12H,8,10H2,1-2H3,(H,21,23)(H,22,24)