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Substance Name: Benzo(b)thiophene-3-methylamine, N-(2-chloroethyl)-N-ethyl-5-fluoro-, hydrochloride
RN: 16584-09-1
InChIKey: CSLQYDNUPSPJPZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-Cl-F-N-S.Cl-H

Molecular Weight

  • 308.246
 
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Names and Synonyms

Synonyms

  • Benzo(b)thiophene-3-methanamine, N-(2-chloroethyl)-N-ethyl-5-fluoro-, hydrochloride
  • N-(2-Chloroethyl)-N-ethyl-5-fluorobenzo(b)thiophene-3-methylamine hydrochloride

Systematic Name

  • Benzo(b)thiophene-3-methylamine, N-(2-chloroethyl)-N-ethyl-5-fluoro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 16584-09-1

System Generated Number

  • 0016584091

Molecular Formulas

Molecular Formula

  • C13-H15-Cl-F-N-S.Cl-H

Molecular Formula Fragments

  • C13-H15-Cl-F-N-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H15ClFNS.ClH/c1-2-16(6-5-14)8-10-9-17-13-4-3-11(15)7-12(10)13;/h3-4,7,9H,2,5-6,8H2,1H3;1H

InChIKey

CSLQYDNUPSPJPZ-UHFFFAOYSA-N

Smiles

c12c(c(cs1)C[N@@](CC)CCCl)cc(cc2)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Journal of the Chemical Society, Section C: Organic. Vol. (5), Pg. 518, 1968.