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Substance Name: 2-Pyrrolidinone, 5-ethoxy-1-((3-(methylsulfonyl)phenyl)sulfonyl)-
RN: 111711-75-2
InChIKey: QRNMKOLIGWORBL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-N-O6-S2

Molecular Weight

  • 347.4103
 
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Names and Synonyms

Synonyms

  • 5-Ethoxy-1-((3-(methylsulfonyl)phenyl)sulfonyl)-2-pyrrolidinone
  • BRN 4763960

Systematic Name

  • 2-Pyrrolidinone, 5-ethoxy-1-((3-(methylsulfonyl)phenyl)sulfonyl)-

Registry Numbers

CAS Registry Number

  • 111711-75-2

System Generated Number

  • 0111711752

Structure Descriptors

InChI

1S/C13H17NO6S2/c1-3-20-13-8-7-12(15)14(13)22(18,19)11-6-4-5-10(9-11)21(2,16)17/h4-6,9,13H,3,7-8H2,1-2H3

InChIKey

QRNMKOLIGWORBL-UHFFFAOYSA-N

Smiles

CCOC1CCC(=O)N1S(=O)(=O)c2cccc(c2)S(=O)(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 403, 1991.