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Substance Name: Urea, N-(2-chloroethyl)-N'-(3-(2,3-dioxo-4-octyl-1-piperazinyl)propyl)-N-nitroso-
RN: 69000-89-1
InChIKey: LVVMAEZMCKGEQT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H32-Cl-N5-O4

Molecular Weight

  • 417.9348
 
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Names and Synonyms

Synonyms

  • 5-24-05-00291 (Beilstein Handbook Reference)
  • BRN 0860647
  • N-(2-Chloroethyl)-N-nitroso-N'-(3-(4-octyl-2,3-dioxo-1-piperazinyl)propyl)urea

Systematic Name

  • Urea, N-(2-chloroethyl)-N'-(3-(2,3-dioxo-4-octyl-1-piperazinyl)propyl)-N-nitroso-

Registry Numbers

CAS Registry Number

  • 69000-89-1

System Generated Number

  • 0069000891

Structure Descriptors

InChI

1S/C18H32ClN5O4/c1-2-3-4-5-6-7-11-22-14-15-23(17(26)16(22)25)12-8-10-20-18(27)24(21-28)13-9-19/h2-15H2,1H3,(H,20,27)

InChIKey

LVVMAEZMCKGEQT-UHFFFAOYSA-N

Smiles

CCCCCCCCN1CCN(C(=O)C1=O)CCCNC(=O)N(CCCl)N=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 177mg/kg (177mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 99, Pg. 738, 1979.