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Substance Name: 2-Propanol, 1-((4-fluorophenyl)amino)-3-((1-phenyl-1H-tetrazol-5-yl)thio)-
RN: 133506-54-4
InChIKey: RUMDPIABWWMYSM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-F-N5-O-S

Molecular Weight

  • 345.4004
 
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Names and Synonyms

Synonym

  • 1-((4-Fluorophenyl)amino)-3-((1-phenyl-1H-tetrazol-5-yl)thio)-2-propanol

Systematic Name

  • 2-Propanol, 1-((4-fluorophenyl)amino)-3-((1-phenyl-1H-tetrazol-5-yl)thio)-

Registry Numbers

CAS Registry Number

  • 133506-54-4

System Generated Number

  • 0133506544

Structure Descriptors

InChI

1S/C16H16FN5OS/c17-12-6-8-13(9-7-12)18-10-15(23)11-24-16-19-20-21-22(16)14-4-2-1-3-5-14/h1-9,15,18,23H,10-11H2

InChIKey

RUMDPIABWWMYSM-UHFFFAOYSA-N

Smiles

c1ccc(cc1)n2c(nnn2)SCC(CNc3ccc(cc3)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   Cesko-Slovenska Farmacie. Vol. 39, Pg. 294, 1990.