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Substance Name: Thiocyanic acid, 2-(1,3-benzodioxol-5-yl)-6-phenylimidazo(2,1-b)-1,3,4-thiadiazol-5-yl ester
RN: 91918-82-0
InChIKey: LBBOPVNOGORIHW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H10-N4-O2-S2

Molecular Weight

  • 378.435
 
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Names and Synonyms

Synonym

  • 2-(1,3-Benzodioxol-5-yl)-6-phenylimidazo(2,1-b)-1,3,4-thiadiazol-5-yl thiocyanate

Systematic Name

  • Thiocyanic acid, 2-(1,3-benzodioxol-5-yl)-6-phenylimidazo(2,1-b)-1,3,4-thiadiazol-5-yl ester

Registry Numbers

CAS Registry Number

  • 91918-82-0

System Generated Number

  • 0091918820

Structure Descriptors

InChI

1S/C18H10N4O2S2/c19-9-25-17-15(11-4-2-1-3-5-11)20-18-22(17)21-16(26-18)12-6-7-13-14(8-12)24-10-23-13/h1-8H,10H2

InChIKey

LBBOPVNOGORIHW-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2c(n3c(n2)sc(n3)c4ccc5c(c4)OCO5)SC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 800mg/kg (800mg/kg)   Farmaco, Edizione Scientifica. Vol. 39, Pg. 585, 1984.
rat LD intraperitoneal > 800mg/kg (800mg/kg)   Farmaco, Edizione Scientifica. Vol. 39, Pg. 585, 1984.