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Substance Name: 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((2-methylphenyl)amino)thioxomethyl)hydrazide
RN: 94771-95-6
InChIKey: KGSLMZUNIBMDAF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-N7-O3-S

Molecular Weight

  • 427.4869
 
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Names and Synonyms

Synonyms

  • 1-(5-(3,4-Dimethoxyphenyl)tetrazol-2-ylacetyl)-4-(2-methylphenyl)thiosemicarbazide
  • 4-(2-Methylphenyl)-1-(5-(3,4-dimethoxyphenyl)tetrazol-2-yl-acetyl)thiosemicarbazide
  • BRN 4603990

Systematic Name

  • 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((2-methylphenyl)amino)thioxomethyl)hydrazide

Registry Numbers

CAS Registry Number

  • 94771-95-6

System Generated Number

  • 0094771956

Structure Descriptors

InChI

1S/C19H21N7O3S/c1-12-6-4-5-7-14(12)20-19(30)23-21-17(27)11-26-24-18(22-25-26)13-8-9-15(28-2)16(10-13)29-3/h4-10H,11H2,1-3H3,(H,21,27)(H2,20,23,30)

InChIKey

KGSLMZUNIBMDAF-UHFFFAOYSA-N

Smiles

N(NC(=S)Nc1c(cccc1)C)C(=O)Cn1nc(nn1)c1cc(c(cc1)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Pharmacology: International Journal of Experimental and Clinical Pharmacology. Vol. 35, Pg. 333, 1987.
mouse LD50 oral 500mg/kg (500mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 23, Pg. 1133, 1984.