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Substance Name: Sch 23154
RN: 75255-01-5
InChIKey: GJAPTEZCCQHYLN-RIYZIHGNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-N3-O5-S

Molecular Weight

  • 327.359
 
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Names and Synonyms

Name of Substance

  • Sch 23154

Synonyms

  • 1-(2-Nitro-4-propyloxyphenyl)-3-carbomethoxy-S-methylisothiourea
  • Sch 23154

Systematic Names

  • Carbamic acid, (((2-nitro-4-propoxyphenyl)imino)methylthiomethyl)-, methyl ester
  • Carbamic acid, ((methylthio)((2-nitro-4-propoxyphenyl)amino)methylene)-, methyl ester

Registry Numbers

CAS Registry Number

  • 75255-01-5

System Generated Number

  • 0075255015

Structure Descriptors

InChI

1S/C13H17N3O5S/c1-3-6-21-10-4-5-11(12(7-10)16(18)19)14-8-22-9-15-13(17)20-2/h4-5,7-8H,3,6,9H2,1-2H3,(H,15,17)/b14-8+

InChIKey

GJAPTEZCCQHYLN-RIYZIHGNSA-N

Smiles

c1(c(ccc(c1)OCCC)\N=C\SCNC(OC)=O)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Journal of Parasitology. Vol. 65, Pg. 823, 1979.
mouse LD50 intravenous 130mg/kg (130mg/kg)   Journal of Parasitology. Vol. 65, Pg. 823, 1979.
mouse LD50 oral > 2gm/kg (2000mg/kg)   Journal of Parasitology. Vol. 65, Pg. 823, 1979.
mouse LD50 subcutaneous > 2gm/kg (2000mg/kg)   Journal of Parasitology. Vol. 65, Pg. 823, 1979.