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Substance Name: 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-ethoxyphenyl)amino)thioxomethyl)hydrazide
RN: 94771-98-9
InChIKey: OEYCFBCKOWTNRW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-N7-O4-S

Molecular Weight

  • 457.5127
 
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Names and Synonyms

Synonyms

  • 1-(5-(3,4-Dimethoxyphenyl)tetrazol-2-ylacetyl)-4-(4-ethoxyphenyl)thiosemicarbazide
  • 4-(4-Ethoxyphenyl)-1-(5-(3,4-dimethoxyphenyl)tetrazol-2-yl-acetyl)thiosemicarbazide
  • BRN 4609304

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 94771-98-9

System Generated Number

  • 0094771989

Structure Descriptors

InChI

1S/C20H23N7O4S/c1-4-31-15-8-6-14(7-9-15)21-20(32)24-22-18(28)12-27-25-19(23-26-27)13-5-10-16(29-2)17(11-13)30-3/h5-11H,4,12H2,1-3H3,(H,22,28)(H2,21,24,32)

InChIKey

OEYCFBCKOWTNRW-UHFFFAOYSA-N

Smiles

N(NC(=S)Nc1ccc(cc1)OCC)C(=O)Cn1nc(nn1)c1cc(c(cc1)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/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.