HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

2-Imidazolidinone, 1-((4-chloro-2-((2-(dimethylamino)ethyl)thio)-5-methylphenyl)sulfonyl)-, monohydrochloride

HCID 60624
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
114436-45-2
Standard SMILES
Cc1cc(S(=O)(=O)N2CCNC2=O)c(SCC[NH+](C)C)cc1Cl.[Cl-]
InChIKey
XDFZGIYSOADENU-UHFFFAOYSA-N
Molecular formula
C14H21Cl2N3O3S2
Average molar mass
414.4 g/mol
Monoisotopic mass
413.0401393

Names & identifiers

Preferred name
2-Imidazolidinone, 1-((4-chloro-2-((2-(dimethylamino)ethyl)thio)-5-methylphenyl)sulfonyl)-, monohydrochloride
IUPAC
2-[5-chloro-4-methyl-2-(2-oxoimidazolidin-1-yl)sulfonylphenyl]sulfanylethyl-dimethylazanium chloride

Names & synonyms

114436-45-22-Imidazolidinone, 1-((4-chloro-2-((2-(dimethylamino)ethyl)thio)-5-methylphenyl)sulfonyl)-, monohydrochloride1-((4-Chloro-2-((2-(dimethylamino)ethyl)thio)-5-methylphenyl)sulfonyl)-2-imidazolidinone HCl1-(4-Chloro-2-(2-dimethylaminoethylthio)-5-methylbenzenesulfonyl)-2-imidazolidinone HClRefChem:261953

Database identifiers

CAS
114436-45-2
PubChem CID
60624

Properties

Computed structural properties

Topological polar surface area
105 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
524

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes