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Substance Name: Benzeneacetic acid, alpha-methyl-alpha-((1,3,4,5-tetrahydrobenz(cd)indol-2-yl)thio)-, ethyl ester
RN: 133182-87-3
InChIKey: BJZIVFSXRWAWAN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H23-N-O2-S

Molecular Weight

  • 365.4947
 
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Names and Synonyms

  • Benzeneacetic acid, alpha-methyl-alpha-((1,3,4,5-tetrahydrobenz(cd)indol-2-yl)thio)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 133182-87-3

System Generated Number

  • 0133182873

Structure Descriptors

InChI

1S/C22H23NO2S/c1-3-25-21(24)22(2,16-11-5-4-6-12-16)26-20-17-13-7-9-15-10-8-14-18(23-20)19(15)17/h4-6,8,10-12,14,23H,3,7,9,13H2,1-2H3

InChIKey

BJZIVFSXRWAWAN-UHFFFAOYSA-N

Smiles

CCOC(=O)C(C)(c1ccccc1)Sc2c3c4c(cccc4[nH]2)CCC3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #5137909,