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Substance Name: Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-amino-6-methyl-, ethyl ester
RN: 76981-71-0
InChIKey: WSOISFMHBFFWRQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H17-N-O2-S

Molecular Weight

  • 239.3373
 
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Names and Synonyms

Synonyms

  • BRN 4183342
  • Ethyl 4,5,6,7-tetrahydro-2-amino-6-methylbenzo(b)thiophene-3-carboxylate

Systematic Name

  • Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-amino-6-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 76981-71-0

System Generated Number

  • 0076981710

Structure Descriptors

InChI

1S/C12H17NO2S/c1-3-15-12(14)10-8-5-4-7(2)6-9(8)16-11(10)13/h7H,3-6,13H2,1-2H3

InChIKey

WSOISFMHBFFWRQ-UHFFFAOYSA-N

Smiles

CCOC(=O)c1c2c(sc1N)CC(CC2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 1gm/kg (1000mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 15, Pg. 413, 1980.