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Substance Name: 1H-Imidazole, 5-((2-(diethylamino)ethyl)thio)-2-methyl-4-nitro-1-(phenylmethyl)-
RN: 110579-05-0
InChIKey: QIPGBOOEMOFHOI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H24-N4-O2-S

Molecular Weight

  • 348.4686
 
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Names and Synonyms

Synonyms

  • 1-(Phenylmethyl)-5-((2-(diethylamino)ethyl)thio)-2-methyl-4-nitro-1H-imidazole
  • Ethanamine, N,N-diethyl-2-((2-methyl-4-nitro-1-(phenylmethyl)-1H-imidazol-5-yl)thio)-

Systematic Name

  • 1H-Imidazole, 5-((2-(diethylamino)ethyl)thio)-2-methyl-4-nitro-1-(phenylmethyl)-

Registry Numbers

CAS Registry Number

  • 110579-05-0

System Generated Number

  • 0110579050

Structure Descriptors

InChI

1S/C17H24N4O2S/c1-4-19(5-2)11-12-24-17-16(21(22)23)18-14(3)20(17)13-15-9-7-6-8-10-15/h6-10H,4-5,11-13H2,1-3H3

InChIKey

QIPGBOOEMOFHOI-UHFFFAOYSA-N

Smiles

CCN(CC)CCSc1c(nc(n1Cc2ccccc2)C)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 200mg/kg (200mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 403, 1987.