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Substance Name: Benzenecarbothioic acid, 2-(acetyloxy)-, S-(5-(((phenylamino)thioxomethyl)amino)-1,3,4-thiadiazol-2-yl) ester
RN: 86910-87-4
InChIKey: BSZWTWTXZXJTJZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H14-N4-O3-S3

Molecular Weight

  • 430.5316
 
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Names and Synonyms

  • Benzenecarbothioic acid, 2-(acetyloxy)-, S-(5-(((phenylamino)thioxomethyl)amino)-1,3,4-thiadiazol-2-yl) ester

Registry Numbers

CAS Registry Number

  • 86910-87-4

System Generated Number

  • 0086910874

Structure Descriptors

InChI

1S/C18H14N4O3S3/c1-11(23)25-14-10-6-5-9-13(14)15(24)27-18-22-21-17(28-18)20-16(26)19-12-7-3-2-4-8-12/h2-10H,1H3,(H2,19,20,21,26)

InChIKey

BSZWTWTXZXJTJZ-UHFFFAOYSA-N

Smiles

CC(=O)Oc1ccccc1C(=O)Sc2nnc(s2)NC(=S)Nc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg)   Pharmacological Research Communications. Vol. 15, Pg. 253, 1983.