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Substance Name: Benzenesulfonic acid, 4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide
RN: 116854-85-4
InChIKey: MGQRUGSJPCLDCV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H17-N5-O2-S3

Molecular Weight

  • 455.5853
 
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Names and Synonyms

Synonym

  • 4-(((Phenylamino)thioxomethyl)amino)benzenesulfonic acid 2-(2-benzothiazolyl)hydrazide

Systematic Name

  • Benzenesulfonic acid, 4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide

Registry Numbers

CAS Registry Number

  • 116854-85-4

System Generated Number

  • 0116854854

Structure Descriptors

InChI

1S/C20H17N5O2S3/c26-30(27,25-24-20-23-17-8-4-5-9-18(17)29-20)16-12-10-15(11-13-16)22-19(28)21-14-6-2-1-3-7-14/h1-13,25H,(H,23,24)(H2,21,22,28)

InChIKey

MGQRUGSJPCLDCV-UHFFFAOYSA-N

Smiles

c1ccc(cc1)NC(=S)Nc2ccc(cc2)S(=O)(=O)NNc3nc4ccccc4s3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 50, Pg. 29, 1988.
mouse LD50 oral 1600mg/kg (1600mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 50, Pg. 29, 1988.