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Substance Name: Benzamide, N-((bis(2-chloroethyl)amino)methyl)-4-nitro-
RN: 40478-20-4
InChIKey: TYVFKLZVXGKKMZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-Cl2-N3-O3

Molecular Weight

  • 320.1745
 
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Names and Synonyms

Synonyms

  • BRN 2004675
  • N-((Bis(2-chloroethyl)amino)methyl)-4-nitrobenzamide
  • N-(Bis(2-chloraethyl)aminomethyl)-4-nitrobenzamid
  • N-(Bis(2-chloraethyl)aminomethyl)-4-nitrobenzamid [German]

Systematic Name

  • Benzamide, N-((bis(2-chloroethyl)amino)methyl)-4-nitro-

Registry Numbers

CAS Registry Number

  • 40478-20-4

System Generated Number

  • 0040478204

Structure Descriptors

InChI

1S/C12H15Cl2N3O3/c13-5-7-16(8-6-14)9-15-12(18)10-1-3-11(4-2-10)17(19)20/h1-4H,5-9H2,(H,15,18)

InChIKey

TYVFKLZVXGKKMZ-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(=O)NCN(CCCl)CCCl)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 105mg/kg (105mg/kg)   Archiv der Pharmazie Vol. 306, Pg. 64, 1973.
rat LD50 intramuscular 32mg/kg (32mg/kg)   Archiv der Pharmazie Vol. 306, Pg. 64, 1973.