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Substance Name: 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((bis(2-hydroxyethyl)amino)methyl)-5-nitro-
RN: 112094-13-0
InChIKey: LCRGYGFPFOKIFT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N5-O6-S

Molecular Weight

  • 429.4953
 
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Names and Synonyms

Synonyms

  • 1,3-Dihydro-1,3-bis((bis(2-hydroxyethyl)amino)methyl)-5-nitro-2H-benzimidazole-2-thione
  • RTECS DD3836000

Systematic Name

  • 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((bis(2-hydroxyethyl)amino)methyl)-5-nitro-

Registry Numbers

CAS Registry Number

  • 112094-13-0

System Generated Number

  • 0112094130

Structure Descriptors

InChI

1S/C17H27N5O6S/c23-7-3-18(4-8-24)12-20-15-2-1-14(22(27)28)11-16(15)21(17(20)29)13-19(5-9-25)6-10-26/h1-2,11,23-26H,3-10,12-13H2

InChIKey

LCRGYGFPFOKIFT-UHFFFAOYSA-N

Smiles

c1cc2c(cc1[N+](=O)[O-])n(c(=S)n2CN(CCO)CCO)CN(CCO)CCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1600mg/kg (1600mg/kg)   Indian Drugs. Vol. 24, Pg. 542, 1987.