[4-(4-chloranyl-3-sulfamoyl-phenyl)-3-ethyl-4-oxidanyl-1,3-thiazolidin-2-ylidene]-dimethyl-azanium bromide

Systemtic Name: [4-(4-chloranyl-3-sulfamoyl-phenyl)-3-ethyl-4-oxidanyl-1,3-thiazolidin-2-ylidene]-dimethyl-azanium bromide Openeye Name: [4-(4-chloro-3-sulfamoyl-phenyl)-3-ethyl-4-hydroxy-thiazolidin-2-ylidene]-dimethyl-ammonium bromide CAS Name: [4-(4-chloro-3-sulfamoylphenyl)-3-ethyl-4-hydroxy-2-thiazolidinylidene]-dimethylammonium bromide IUPAC Name: [4-(4-chloro-3-sulfamoylphenyl)-3-ethyl-4-hydroxy-1,3-thiazolidin-2-ylidene]-dimethylazanium bromide Traditional Name: [4-(4-chloro-3-sulfamoyl-phenyl)-3-ethyl-4-hydroxy-thiazolidin-2-ylidene]-dimethyl-ammonium bromide Formula: C13H19BrClN3O3S2 MolecularWeight: 444.79526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C)C)SCC1(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O.[Br-]

Isomeric SMILES

CCN1C(=[N+](C)C)SCC1(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O.[Br-]

InChI

InChI=1S/C13H19ClN3O3S2.BrH/c1-4-17-12(16(2)3)21-8-13(17,18)9-5-6-10(14)11(7-9)22(15,19)20;/h5-7,18H,4,8H2,1-3H3,(H2,15,19,20);1H/q+1;/p-1