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Substance Name: 2-Imidazoline-1-carboxylic acid, 2-allylthio-, methyl ester
RN: 61076-84-4
InChIKey: OPCDKHZQXSNOBB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H12-N2-O2-S

Molecular Weight

  • 200.261
 
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Names and Synonyms

Synonyms

  • 2-Allylthio-2-imidazoline-1-carboxylic acid methyl ester
  • Imidazolidine, 2-allylthio-3-methoxycarbonyl-

Systematic Name

  • 2-Imidazoline-1-carboxylic acid, 2-allylthio-, methyl ester

Registry Numbers

CAS Registry Number

  • 61076-84-4

System Generated Number

  • 0061076844

Structure Descriptors

InChI

1S/C8H12N2O2S/c1-3-6-13-7-9-4-5-10(7)8(11)12-2/h3H,1,4-6H2,2H3

InChIKey

OPCDKHZQXSNOBB-UHFFFAOYSA-N

Smiles

N1(C(SCC=C)=NCC1)C(OC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 88mg/kg (88mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) Journal of Pharmaceutical Sciences. Vol. 67, Pg. 600, 1978.