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Substance Name: Benzoic acid, 2-(acetyloxy)-, 2-((1-phenyl-1H-tetrazol-5-yl)thio)ethyl ester
RN: 133506-50-0
InChIKey: DKNYQBARFMFUHA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-N4-O4-S

Molecular Weight

  • 384.4144
 
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Names and Synonyms

Synonyms

  • 2-((1-Phenyl-1H-tetrazol-5-yl)thio)ethyl 2-(acetyloxy)benzoate
  • RTECS DI0616000

Systematic Name

  • Benzoic acid, 2-(acetyloxy)-, 2-((1-phenyl-1H-tetrazol-5-yl)thio)ethyl ester

Registry Numbers

CAS Registry Number

  • 133506-50-0

System Generated Number

  • 0133506500

Structure Descriptors

InChI

1S/C18H16N4O4S/c1-13(23)26-16-10-6-5-9-15(16)17(24)25-11-12-27-18-19-20-21-22(18)14-7-3-2-4-8-14/h2-10H,11-12H2,1H3

InChIKey

DKNYQBARFMFUHA-UHFFFAOYSA-N

Smiles

CC(=O)Oc1ccccc1C(=O)OCCSc2nnnn2c3ccccc3

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.