Compound C14H21Cl2N3O3S2

2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonylphenyl]sulfanylethyl-dimethylazanium chloride

CAS: 114436-45-2

Molecular Formula	`C14H21Cl2N3O3S2`
Molecular Weight	414.4 g/mol
Topological Polar Surface Area	105.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	413.04013
Heavy Atoms	24
Complexity	524.0

Chemical Identifiers

CAS Number	114436-45-2
SMILES	`CC1=CC(=C(C=C1Cl)SCC[NH+](C)C)S(=O)(=O)N2CCNC2=O.[Cl-]`
InChIKey	`XDFZGIYSOADENU-UHFFFAOYSA-N`

📖 Product Overview

Compound C14H21Cl2N3O3S2 (CAS: 114436-45-2) is a chemical compound with molecular formula C14H21Cl2N3O3S2 and molecular weight 414.4 g/mol. Its IUPAC systematic name is 2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonylphenyl]sulfanylethyl-dimethylazanium chloride. Topological Polar Surface Area 105.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 413.04013 Heavy Atoms 24 Complexity 524.0 InChI Key: XDFZGIYSOADENU-UHFFFAOYSA-N. SMILES: CC1=CC(=C(C=C1Cl)SCC[NH+](C)C)S(=O)(=O)N2CCNC2=O.[Cl-].

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