[azanyl-[2-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-2-oxidanyl-ethyl]sulfanyl-methylidene]-dimethyl-azanium

Systemtic Name: [azanyl-[2-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-2-oxidanyl-ethyl]sulfanyl-methylidene]-dimethyl-azanium Openeye Name: [amino-[2-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-hydroxy-ethyl]sulfanyl-methylene]-dimethyl-ammonium CAS Name: [amino-[[2-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-hydroxyethyl]thio]methylidene]-dimethylammonium IUPAC Name: [amino-[2-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-hydroxyethyl]sulfanylmethylidene]-dimethylazanium Traditional Name: [amino-[[2-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-hydroxy-ethyl]thio]methylene]-dimethyl-ammonium Formula: C13H21ClN3O3S2+ MolecularWeight: 366.90714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(CSC(=[N+](C)C)N)O)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(CSC(=[N+](C)C)N)O)Cl

InChI

InChI=1S/C13H20ClN3O3S2/c1-16(2)13(15)21-8-11(18)9-5-6-10(14)12(7-9)22(19,20)17(3)4/h5-7,11,15,18H,8H2,1-4H3/p+1