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Substance Name: 4H-Cyclopentathiazole, 3a,5,6,6a-tetrahydro-2-phenyl-, cis-
RN: 96159-93-2
InChIKey: UYXYIVZSKJTQIZ-MNOVXSKESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H13-N-S

Molecular Weight

  • 203.3077
 
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Names and Synonyms

Synonyms

  • BRN 5000014
  • cis-3a,5,6,6a-Tetrahydro-2-phenyl-4H-cyclopentathiazole

Systematic Name

  • 4H-Cyclopentathiazole, 3a,5,6,6a-tetrahydro-2-phenyl-, cis-

Registry Numbers

CAS Registry Number

  • 96159-93-2

System Generated Number

  • 0096159932

Structure Descriptors

InChI

1S/C12H13NS/c1-2-5-9(6-3-1)12-13-10-7-4-8-11(10)14-12/h1-3,5-6,10-11H,4,7-8H2/t10-,11+/m1/s1

InChIKey

UYXYIVZSKJTQIZ-MNOVXSKESA-N

Smiles

c1ccc(cc1)C2=N[C@@H]3CCC[C@@H]3S2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 20, Pg. 16, 1985.