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Substance Name: Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate
RN: 110826-52-3
InChIKey: LXTQNTCIXNHFJL-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H16-N-O-S.Cl-O4

Molecular Weight

  • 297.7574
 
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Names and Synonyms

Synonym

  • (4-(2-Oxopyrrolidinyl)-2-butynyl)dimethylsulfonium perchlorate

Systematic Name

  • Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate

Registry Numbers

CAS Registry Number

  • 110826-52-3

System Generated Number

  • 0110826523

Molecular Formulas

Molecular Formula

  • C10-H16-N-O-S.Cl-O4

Molecular Formula Fragments

  • C10-H16-N-O-S
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C10H16NOS.ClHO4/c1-13(2)9-4-3-7-11-8-5-6-10(11)12;2-1(3,4)5/h5-9H2,1-2H3;(H,2,3,4,5)/q+1;/p-1

InChIKey

LXTQNTCIXNHFJL-UHFFFAOYSA-M

Smiles

C[S+](C)CC#CCN1CCCC1=O.[O-]Cl(=O)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 834ug/kg (0.834mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS Journal of Medicinal Chemistry. Vol. 31, Pg. 164, 1988.