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

Systemtic Name: [4-(4-chloranyl-3-sulfamoyl-phenyl)-3-cyclopropyl-4-oxidanyl-1,3-thiazolidin-2-ylidene]-dimethyl-azanium bromide Openeye Name: [4-(4-chloro-3-sulfamoyl-phenyl)-3-cyclopropyl-4-hydroxy-thiazolidin-2-ylidene]-dimethyl-ammonium bromide CAS Name: [4-(4-chloro-3-sulfamoylphenyl)-3-cyclopropyl-4-hydroxy-2-thiazolidinylidene]-dimethylammonium bromide IUPAC Name: [4-(4-chloro-3-sulfamoylphenyl)-3-cyclopropyl-4-hydroxy-1,3-thiazolidin-2-ylidene]-dimethylazanium bromide Traditional Name: [4-(4-chloro-3-sulfamoyl-phenyl)-3-cyclopropyl-4-hydroxy-thiazolidin-2-ylidene]-dimethyl-ammonium bromide Formula: C14H19BrClN3O3S2 MolecularWeight: 456.80596

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1N(C(CS1)(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O)C3CC3)C.[Br-]

Isomeric SMILES

C[N+](=C1N(C(CS1)(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O)C3CC3)C.[Br-]

InChI

InChI=1S/C14H19ClN3O3S2.BrH/c1-17(2)13-18(10-4-5-10)14(19,8-22-13)9-3-6-11(15)12(7-9)23(16,20)21;/h3,6-7,10,19H,4-5,8H2,1-2H3,(H2,16,20,21);1H/q+1;/p-1