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Substance Name: 1,3,4-Thiadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-phenyl-
RN: 83796-18-3
InChIKey: NIRXRSLSDTWCDS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H11-N3-O2-S

Molecular Weight

  • 297.3369
 
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Names and Synonyms

Synonym

  • 2-(1,3-Benzodioxol-5-yl)-2-phenylamino-1,3,4-thiadiazole

Systematic Name

  • 1,3,4-Thiadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-phenyl-

Registry Numbers

CAS Registry Number

  • 83796-18-3

System Generated Number

  • 0083796183

Structure Descriptors

InChI

1S/C15H11N3O2S/c1-2-4-11(5-3-1)16-15-18-17-14(21-15)10-6-7-12-13(8-10)20-9-19-12/h1-8H,9H2,(H,16,18)

InChIKey

NIRXRSLSDTWCDS-UHFFFAOYSA-N

Smiles

c1ccc(cc1)Nc2nnc(s2)c3ccc4c(c3)OCO4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 450mg/kg (450mg/kg)   Farmaco, Edizione Scientifica. Vol. 37, Pg. 685, 1982.