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

Systemtic Name: [4-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-3-cyclohexyl-4-oxidanyl-1,3-thiazolidin-2-ylidene]-diethyl-azanium bromide Openeye Name: [4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-cyclohexyl-4-hydroxy-thiazolidin-2-ylidene]-diethyl-ammonium bromide CAS Name: [4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-cyclohexyl-4-hydroxy-2-thiazolidinylidene]-diethylammonium bromide IUPAC Name: [4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-cyclohexyl-4-hydroxy-1,3-thiazolidin-2-ylidene]-diethylazanium bromide Traditional Name: [4-[4-chloro-3-(dimethylsulfamoyl)phenyl]-3-cyclohexyl-4-hydroxy-thiazolidin-2-ylidene]-diethyl-ammonium bromide Formula: C21H33BrClN3O3S2 MolecularWeight: 554.99202

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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)C3CCCCC3)CC.[Br-]

Isomeric SMILES

CC[N+](=C1N(C(CS1)(C2=CC(=C(C=C2)Cl)S(=O)(=O)N(C)C)O)C3CCCCC3)CC.[Br-]

InChI

InChI=1S/C21H33ClN3O3S2.BrH/c1-5-24(6-2)20-25(17-10-8-7-9-11-17)21(26,15-29-20)16-12-13-18(22)19(14-16)30(27,28)23(3)4;/h12-14,17,26H,5-11,15H2,1-4H3;1H/q+1;/p-1