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Substance Name: Benzenecarbothioamide, N-(2-(1H-indol-3-yl)ethyl)-
RN: 10022-75-0
InChIKey: SEBJYQOWJZGGLP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H16-N2-S

Molecular Weight

  • 280.393
 
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Names and Synonyms

Synonyms

  • 5-22-10-00081 (Beilstein Handbook Reference)
  • BRN 0410578
  • N-(2-(1H-Indol-3-yl)ethyl)benzenecarbothioamide
  • RTECS CV9800000

Systematic Name

  • Benzenecarbothioamide, N-(2-(1H-indol-3-yl)ethyl)-

Registry Numbers

CAS Registry Number

  • 10022-75-0

System Generated Number

  • 0010022750

Structure Descriptors

InChI

1S/C17H16N2S/c20-17(13-6-2-1-3-7-13)18-11-10-14-12-19-16-9-5-4-8-15(14)16/h1-9,12,19H,10-11H2,(H,18,20)

InChIKey

SEBJYQOWJZGGLP-UHFFFAOYSA-N

Smiles

c1(ccccc1)C(NCCc1c[nH]c2ccccc12)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 561mg/kg (561mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 94, Pg. 1620, 1974.