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Substance Name: Pseudourea, 2-(4-nitrobenzyl)-1,3-dicyclohexyl-2-thio-, hydrochloride
RN: 15314-72-4
InChIKey: MOACAMDJBOJSGN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-N3-O2-S.Cl-H

Molecular Weight

  • 411.995
 
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Names and Synonyms

Synonym

  • 2-(4-Nitrobenzyl)-1,3-dicyclohexyl-2-thiopseudourea hydrochloride

Systematic Name

  • Pseudourea, 2-(4-nitrobenzyl)-1,3-dicyclohexyl-2-thio-, hydrochloride

Registry Numbers

CAS Registry Number

  • 15314-72-4

System Generated Number

  • 0015314724

Molecular Formulas

Molecular Formula

  • C20-H29-N3-O2-S.Cl-H

Molecular Formula Fragments

  • C20-H29-N3-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H29N3O2S.ClH/c24-23(25)19-13-11-16(12-14-19)15-26-20(21-17-7-3-1-4-8-17)22-18-9-5-2-6-10-18;/h11-14,17-18H,1-10,15H2,(H,21,22);1H

InChIKey

MOACAMDJBOJSGN-UHFFFAOYSA-N

Smiles

N(=C(\SCc1ccc(cc1)[N+](=O)[O-])NC1CCCCC1)\C1CCCCC1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Journal of Medicinal Chemistry. Vol. 10, Pg. 649, 1967.