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Substance Name: 3-Pyrrolidine, 2-(chloroacetyl)-1-((4-methylphenyl)sulfonyl)-, (S)-
RN: 63762-06-1
InChIKey: FYVAGIMTCLFTRI-LBPRGKRZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-Cl-N-O3-S

Molecular Weight

  • 301.7924
 
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Names and Synonyms

Synonyms

  • (S)-2-(Chloroacetyl)-1-((4-methylphenyl)sulfonyl)-3-pyrrolidine
  • BRN 1486462
  • N-Tosyl-L-proline chloromethyl ketone

Systematic Name

  • 3-Pyrrolidine, 2-(chloroacetyl)-1-((4-methylphenyl)sulfonyl)-, (S)-

Registry Numbers

CAS Registry Number

  • 63762-06-1

System Generated Number

  • 0063762061

Structure Descriptors

InChI

1S/C13H16ClNO3S/c1-10-4-6-11(7-5-10)19(17,18)15-8-2-3-12(15)13(16)9-14/h4-7,12H,2-3,8-9H2,1H3/t12-/m0/s1

InChIKey

FYVAGIMTCLFTRI-LBPRGKRZSA-N

Smiles

Cc1ccc(cc1)S(=O)(=O)N2CCC[C@H]2C(=O)CCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported > 200mg/kg (200mg/kg)   Journal of Pharmaceutical Sciences. Vol. 69, Pg. 1451, 1980.