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Substance Name: Benzenesulfonic acid, 3-methyl-4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide
RN: 116854-90-1
InChIKey: ZQIIRPUTMZGVOV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H19-N5-O2-S3

Molecular Weight

  • 469.6121
 
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Names and Synonyms

Synonym

  • 3-Methyl-4-(((phenylamino)carbonyl)amino)benzenesulfonic acid 2-(2-benzothiazolyl)hydrazide

Systematic Name

  • Benzenesulfonic acid, 3-methyl-4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide

Registry Numbers

CAS Registry Number

  • 116854-90-1

System Generated Number

  • 0116854901

Structure Descriptors

InChI

1S/C21H19N5O2S3/c1-14-13-16(11-12-17(14)23-20(29)22-15-7-3-2-4-8-15)31(27,28)26-25-21-24-18-9-5-6-10-19(18)30-21/h2-13,26H,1H3,(H,24,25)(H2,22,23,29)

InChIKey

ZQIIRPUTMZGVOV-UHFFFAOYSA-N

Smiles

Cc1cc(ccc1NC(=S)Nc2ccccc2)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 1800mg/kg (1800mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 50, Pg. 29, 1988.