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Substance Name: 1,3,4-Oxadiazole-2(3H)-thione, 5-((4-(2-benzoxazolyl)phenoxy)methyl)-
RN: 100476-50-4
InChIKey: GYBBMXSOLNGVNU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-N3-O3-S

Molecular Weight

  • 325.3469
 
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Names and Synonyms

Synonyms

  • 2-((p-(2-Benzoxazolyl)phenoxy)methyl)-5-mercaptooxadiazole
  • 5-((4-(2-Benzoxazolyl)phenoxy)methyl)-1,3,4-oxadiazole-2(3H)-thione
  • BRN 5990348

Systematic Name

  • 1,3,4-Oxadiazole-2(3H)-thione, 5-((4-(2-benzoxazolyl)phenoxy)methyl)-

Registry Numbers

CAS Registry Number

  • 100476-50-4

System Generated Number

  • 0100476504

Structure Descriptors

InChI

1S/C16H11N3O3S/c23-16-19-18-14(22-16)9-20-11-7-5-10(6-8-11)15-17-12-3-1-2-4-13(12)21-15/h1-8H,9H2,(H,19,23)

InChIKey

GYBBMXSOLNGVNU-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)nc(o2)c3ccc(cc3)OCc4n[nH]c(=S)o4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 383mg/kg (383mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: IRRITABILITY
Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 24, Pg. 280, 1985.