Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Isopropylantipyrine mixed with ethenzamide and caffeine monohydrate (3:5:1)
RN: 82464-70-8
InChIKey: DVULLFCASSYCQU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N2-O.C9-H11-N-O2.C8-H10-N4-O2.H2-O

Molecular Weight

  • 589.693
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Isopropylantipyrine mixed with ethenzamide and caffeine monohydrate (3:5:1)

Synonyms

  • Isopropylantipyrine mixed with ethenzamide and caffeine monohydrate (3:5:1)
  • Ro 04-7683

Systematic Name

  • Benzamide, 2-ethoxy-, mixt. with 1,2-dihydro-1,5-dimethyl-4-(1-methylethyl)-2-phenyl-3H-pyrazol-3-one and 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione hydrate (3:5:1)

Registry Numbers

CAS Registry Number

  • 82464-70-8

System Generated Number

  • 0082464708

Molecular Formulas

Molecular Formula

  • C14-H18-N2-O.C9-H11-N-O2.C8-H10-N4-O2.H2-O

Molecular Formula Fragments

  • C14-H18-N2-O
  • C8-H10-N4-O2
  • C9-H11-N-O2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C14H18N2O.C9H11NO2.C8H10N4O2/c1-10(2)13-11(3)15(4)16(14(13)17)12-8-6-5-7-9-12;1-2-12-8-6-4-3-5-7(8)9(10)11;1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h5-10H,1-4H3;3-6H,2H2,1H3,(H2,10,11);4H,1-3H3

InChIKey

DVULLFCASSYCQU-UHFFFAOYSA-N

Smiles

n1(c2ccccc2)c(c(C(C)C)c(n1C)C)=O.c12c(n(c(=O)n(c1=O)C)C)ncn2C.c1(c(cccc1)OCC)C(N)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 405mg/kg (405mg/kg) BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Yakuri to Chiryo. Pharmacology and Therapeutics. Vol. 10, Pg. 1407, 1982.
mouse LD50 oral 1250mg/kg (1250mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Yakuri to Chiryo. Pharmacology and Therapeutics. Vol. 10, Pg. 1407, 1982.
mouse LD50 subcutaneous 1400mg/kg (1400mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: ATAXIA
Yakuri to Chiryo. Pharmacology and Therapeutics. Vol. 10, Pg. 1407, 1982.