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Substance Name: 2(3H)-Benzothiazolimine, 3-(cyclopropylmethyl)-6-(trifluoromethoxy)-, monohydrobromide
RN: 130997-66-9
InChIKey: JYPIFLPNKOTUIN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H11-F3-N2-O-S.Br-H

Molecular Weight

  • 369.2038
 
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Names and Synonyms

Synonyms

  • 3-(Cyclopropylmethyl)-6-(trifluoromethoxy)-2(3H)-benzothiazolimine monohydrobromide
  • 3-Cyclopropylmethyl-2-imino-6-trifluoromethoxybenzothiazoline hydrobromide

Systematic Name

  • 2(3H)-Benzothiazolimine, 3-(cyclopropylmethyl)-6-(trifluoromethoxy)-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 130997-66-9

System Generated Number

  • 0130997669

Molecular Formulas

Molecular Formula

  • C12-H11-F3-N2-O-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C12-H11-F3-N2-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C12H11F3N2OS.BrH/c13-12(14,15)18-8-3-4-9-10(5-8)19-11(16)17(9)6-7-1-2-7;/h3-5,7,16H,1-2,6H2;1H

InChIKey

JYPIFLPNKOTUIN-UHFFFAOYSA-N

Smiles

c1cc2c(cc1OC(F)(F)F)sc(=N)n2CC3CC3.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 15mg/kg (15mg/kg)   United States Patent Document. Vol. #4980356,