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Substance Name: Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride
RN: 26962-13-0
InChIKey: OZMHRMBAVVOWEZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H33-N3-O2-S.Cl-H

Molecular Weight

  • 452.06
 
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Names and Synonyms

Synonyms

  • 1-(p-Butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thiourea hydrochloride
  • 3-(Diethylamino)methyl-4'-butoxy-4-methoxythiocarbanilide hydrochloride

Systematic Name

  • Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride

Registry Numbers

CAS Registry Number

  • 26962-13-0

System Generated Number

  • 0026962130

Molecular Formulas

Molecular Formula

  • C23-H33-N3-O2-S.Cl-H

Molecular Formula Fragments

  • C23-H33-N3-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H33N3O2S.ClH/c1-5-8-15-28-21-12-9-19(10-13-21)24-23(29)25-20-11-14-22(27-4)18(16-20)17-26(6-2)7-3;/h9-14,16H,5-8,15,17H2,1-4H3,(H2,24,25,29);1H

InChIKey

OZMHRMBAVVOWEZ-UHFFFAOYSA-N

Smiles

N(C(=S)Nc1cc(c(cc1)OC)CN(CC)CC)c1ccc(cc1)OCCCC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 84mg/kg (84mg/kg) IMMUNOLOGICAL INCLUDING ALLERGIC: INCREASED IMMUNE RESPONSE Pharmaceutical Chemistry Journal Vol. 6, Pg. 86, 1972.