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Substance Name: Benzo(b)thiophen-3-amine, 2-nitro-N-(4-(trifluoromethyl)phenyl)-
RN: 149338-12-5
InChIKey: PQNYDEMCPXPKQZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H9-F3-N2-O2-S

Molecular Weight

  • 338.3081
 
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Names and Synonyms

Synonyms

  • 2-Nitro-N-(4-(trifluoromethyl)phenyl)benzo(b)thiophen-3-amine
  • BRN 5829233

Systematic Name

  • Benzo(b)thiophen-3-amine, 2-nitro-N-(4-(trifluoromethyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 149338-12-5

System Generated Number

  • 0149338125

Structure Descriptors

InChI

1S/C15H9F3N2O2S/c16-15(17,18)9-5-7-10(8-6-9)19-13-11-3-1-2-4-12(11)23-14(13)20(21)22/h1-8,19H

InChIKey

PQNYDEMCPXPKQZ-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c(c(s2)[N+](=O)[O-])Nc3ccc(cc3)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Farmaco. Vol. 47, Pg. 1149, 1992.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Farmaco. Vol. 47, Pg. 1149, 1992.