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Substance Name: p-Toluenesulfonamide, N-(3-chloro-1-isopropylacetonyl)-
RN: 26020-35-9
InChIKey: NCKHHRVMFVHPET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-Cl-N-O3-S

Molecular Weight

  • 303.808
 
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Names and Synonyms

Synonyms

  • BRN 5573823
  • N-(3-Chloro-1-isopropylacetonyl)-p-toluenesulfonamide
  • N-Tosyl-L-valine chloromethyl ketone

Systematic Name

  • p-Toluenesulfonamide, N-(3-chloro-1-isopropylacetonyl)-

Registry Numbers

CAS Registry Number

  • 26020-35-9

System Generated Number

  • 0026020359

Structure Descriptors

InChI

1S/C13H18ClNO3S/c1-9(2)13(12(16)8-14)15-19(17,18)11-6-4-10(3)5-7-11/h4-7,9,13,15H,8H2,1-3H3

InChIKey

NCKHHRVMFVHPET-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)C)S(=O)(=O)N[C@@H](C(=O)CCl)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 400mg/kg (400mg/kg)   Journal of Pharmaceutical Sciences. Vol. 69, Pg. 1451, 1980.