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Substance Name: Carbamic acid, (1-(((2-chloroethyl)amino)carbonyl)-3-methylbutyl)-, phenylmethyl ester, (S)-
RN: 83510-60-5
InChIKey: QRTZGSGKEWWPRU-AWEZNQCLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-Cl-N2-O3

Molecular Weight

  • 326.8217
 
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Names and Synonyms

Synonyms

  • BRN 5579991
  • N-Carbobenzoxy-L-leucine chloro-2 ethylamide
  • N-Carbobenzoxy-L-leucine chloro-2 ethylamide [French]
  • Phenylmethyl (S)-(1-(((2-chloroethyl)amino)carbonyl)-3-methylbutyl)carbamate

Systematic Name

  • Carbamic acid, (1-(((2-chloroethyl)amino)carbonyl)-3-methylbutyl)-, phenylmethyl ester, (S)-

Registry Numbers

CAS Registry Number

  • 83510-60-5

System Generated Number

  • 0083510605

Structure Descriptors

InChI

1S/C16H23ClN2O3/c1-12(2)10-14(15(20)18-9-8-17)19-16(21)22-11-13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3,(H,18,20)(H,19,21)/t14-/m0/s1

InChIKey

QRTZGSGKEWWPRU-AWEZNQCLSA-N

Smiles

CC(C)C[C@@H](C(=O)NCCCl)NC(=O)OCc1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 383, 1982.