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Substance Name: Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-hydroxyphenyl)acetyl)-, cis-(+-)-
RN: 146674-55-7
InChIKey: BPTXHTFOUPEKJG-NOZRDPDXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H27-N-O2-S

Molecular Weight

  • 477.6463
 
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Names and Synonyms

Synonyms

  • cis-(+-)-Octahydro-4,4-diphenyl-6-((2-hydroxyphenyl)acetyl)thiopyrano(2,3-c)pyrrole
  • Diphenyl-4,4 ((hydroxy-2 phenyl)acetyl)-6 perhydrothiopyrano(2,3-c)pyrrole-(4aRS,7aRS)-

Systematic Name

  • Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-hydroxyphenyl)acetyl)-, cis-(+-)-

Registry Numbers

CAS Registry Number

  • 146674-55-7

System Generated Number

  • 0146674557

Structure Descriptors

InChI

1S/C27H27NO3S2/c29-24-14-8-7-9-20(24)17-26(30)28-18-23-25(19-28)31-16-15-27(23,32-21-10-3-1-4-11-21)33-22-12-5-2-6-13-22/h1-14,23,25,29H,15-19H2/t23-,25+/m1/s1

InChIKey

BPTXHTFOUPEKJG-NOZRDPDXSA-N

Smiles

c1ccc(cc1)SC2(CCO[C@@H]3[C@H]2CN(C3)C(=O)Cc4ccccc4O)Sc5ccccc5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 100mg/kg (100mg/kg)   European Patent Application. Vol. #0514275,
mouse LD subcutaneous > 40mg/kg (40mg/kg)   European Patent Application. Vol. #0514275,