2-[5-chloranyl-4-methyl-2-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-phenyl]sulfanylethyl-dimethyl-azanium chloride

Systemtic Name: 2-[5-chloranyl-4-methyl-2-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-phenyl]sulfanylethyl-dimethyl-azanium chloride Openeye Name: 2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonyl-phenyl]sulfanylethyl-dimethyl-ammonium chloride CAS Name: 2-[[5-chloro-4-methyl-2-[(2-oxo-1-imidazolidinyl)sulfonyl]phenyl]thio]ethyl-dimethylammonium chloride IUPAC Name: 2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonylphenyl]sulfanylethyl-dimethylazanium chloride Traditional Name: 2-[[5-chloro-2-(2-ketoimidazolidin-1-yl)sulfonyl-4-methyl-phenyl]thio]ethyl-dimethyl-ammonium chloride Formula: C14H21Cl2N3O3S2 MolecularWeight: 414.37084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)SCC[NH+](C)C)S(=O)(=O)N2CCNC2=O.[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)SCC[NH+](C)C)S(=O)(=O)N2CCNC2=O.[Cl-]

InChI

InChI=1S/C14H20ClN3O3S2.ClH/c1-10-8-13(23(20,21)18-5-4-16-14(18)19)12(9-11(10)15)22-7-6-17(2)3;/h8-9H,4-7H2,1-3H3,(H,16,19);1H