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Substance Name: 1-Naphthaleneacetic acid, 2-(((3,4-dimethylphenyl)amino)thioxomethyl)hydrazide
RN: 56987-50-9
InChIKey: JETHICRWUWALKK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H21-N3-O-S

Molecular Weight

  • 363.483
 
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Names and Synonyms

Synonym

  • 2-(((3,4-Dimethylphenyl)amino)thioxomethyl)hydrazide of 1-naphthaleneacetic acid

Systematic Name

  • 1-Naphthaleneacetic acid, 2-(((3,4-dimethylphenyl)amino)thioxomethyl)hydrazide

Registry Numbers

CAS Registry Number

  • 56987-50-9

System Generated Number

  • 0056987509

Structure Descriptors

InChI

1S/C21H21N3OS/c1-14-10-11-18(12-15(14)2)22-21(26)24-23-20(25)13-17-8-5-7-16-6-3-4-9-19(16)17/h3-12H,13H2,1-2H3,(H,23,25)(H2,22,24,26)

InChIKey

JETHICRWUWALKK-UHFFFAOYSA-N

Smiles

c12c(cccc1cccc2)CC(NNC(Nc1cc(c(C)cc1)C)=S)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Research Communications in Chemical Pathology and Pharmacology. Vol. 11, Pg. 581, 1975.