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

Systemtic Name: [4-(4-chloranyl-3-methyl-2-sulfamoyl-phenyl)-3-ethyl-4-oxidanyl-1,3-thiazolidin-2-ylidene]-diethyl-azanium bromide Openeye Name: [4-(4-chloro-3-methyl-2-sulfamoyl-phenyl)-3-ethyl-4-hydroxy-thiazolidin-2-ylidene]-diethyl-ammonium bromide CAS Name: [4-(4-chloro-3-methyl-2-sulfamoylphenyl)-3-ethyl-4-hydroxy-2-thiazolidinylidene]-diethylammonium bromide IUPAC Name: [4-(4-chloro-3-methyl-2-sulfamoylphenyl)-3-ethyl-4-hydroxy-1,3-thiazolidin-2-ylidene]-diethylazanium bromide Traditional Name: [4-(4-chloro-3-methyl-2-sulfamoyl-phenyl)-3-ethyl-4-hydroxy-thiazolidin-2-ylidene]-diethyl-ammonium bromide Formula: C16H25BrClN3O3S2 MolecularWeight: 486.875

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN3O3S2.BrH/c1-5-19(6-2)15-20(7-3)16(21,10-24-15)12-8-9-13(17)11(4)14(12)25(18,22)23;/h8-9,21H,5-7,10H2,1-4H3,(H2,18,22,23);1H/q+1;/p-1