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

Systemtic Name: 2-[5-chloranyl-4-methyl-2-(2-oxidanylideneimidazolidin-1-yl)sulfonyl-phenyl]sulfanylethyl-diethyl-azanium chloride Openeye Name: 2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonyl-phenyl]sulfanylethyl-diethyl-ammonium chloride CAS Name: 2-[[5-chloro-4-methyl-2-[(2-oxo-1-imidazolidinyl)sulfonyl]phenyl]thio]ethyl-diethylammonium chloride IUPAC Name: 2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonylphenyl]sulfanylethyl-diethylazanium chloride Traditional Name: 2-[[5-chloro-2-(2-ketoimidazolidin-1-yl)sulfonyl-4-methyl-phenyl]thio]ethyl-diethyl-ammonium chloride Formula: C16H25Cl2N3O3S2 MolecularWeight: 442.424

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC1=C(C=C(C(=C1)Cl)C)S(=O)(=O)N2CCNC2=O.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCSC1=C(C=C(C(=C1)Cl)C)S(=O)(=O)N2CCNC2=O.[Cl-]

InChI

InChI=1S/C16H24ClN3O3S2.ClH/c1-4-19(5-2)8-9-24-14-11-13(17)12(3)10-15(14)25(22,23)20-7-6-18-16(20)21;/h10-11H,4-9H2,1-3H3,(H,18,21);1H