[4-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-4-oxidanyl-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-diethyl-azanium bromide

Systemtic Name: [4-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-4-oxidanyl-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-diethyl-azanium bromide Openeye Name: [3-allyl-4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-4-hydroxy-thiazolidin-2-ylidene]-diethyl-ammonium bromide CAS Name: [4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-4-hydroxy-3-prop-2-enyl-2-thiazolidinylidene]-diethylammonium bromide IUPAC Name: [4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-4-hydroxy-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-diethylazanium bromide Traditional Name: [3-allyl-4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-4-hydroxy-thiazolidin-2-ylidene]-diethyl-ammonium bromide Formula: C18H27BrClN3O3S2 MolecularWeight: 512.91228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27ClN3O3S2.BrH/c1-6-11-22-17(21(7-2)8-3)26-13-18(22,23)14-9-10-15(19)16(12-14)27(24,25)20(4)5;/h6,9-10,12,23H,1,7-8,11,13H2,2-5H3;1H/q+1;/p-1