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Substance Name: Ethanamine, N,N-bis(1-methylethyl)-2-((2-fluoro-6,11-dihydrodibenz(b,e)oxepin-11-yl)thio)-
RN: 87673-21-0
InChIKey: RGWQRKLOLZBKFN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-F-N-O-S

Molecular Weight

  • 373.5332
 
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Names and Synonyms

Synonyms

  • 2-((2-Fluoro-6,11-dihydrodibenz(b,e)oxepin-11-yl)thio)-N,N-bis(1-methylethyl)ethanamine
  • 2-Fluoro-11-(2-(diisopropylamino)ethyl)thio-6,11-dihydrodibenz(b,e)oxepin

Systematic Name

  • Ethanamine, N,N-bis(1-methylethyl)-2-((2-fluoro-6,11-dihydrodibenz(b,e)oxepin-11-yl)thio)-

Registry Numbers

CAS Registry Number

  • 87673-21-0

System Generated Number

  • 0087673210

Structure Descriptors

InChI

1S/C22H28FNOS/c1-15(2)24(16(3)4)11-12-26-22-19-8-6-5-7-17(19)14-25-21-10-9-18(23)13-20(21)22/h5-10,13,15-16,22H,11-12,14H2,1-4H3

InChIKey

RGWQRKLOLZBKFN-UHFFFAOYSA-N

Smiles

CC(C)N(CCSC1c2ccccc2COc3c1cc(cc3)F)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   European Patent Application. Vol. #0085870,
mouse LD oral > 300mg/kg (300mg/kg)   European Patent Application. Vol. #0085870,