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Substance Name: Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperazinyl)propyl)sulfonyl)phenyl)-, monohydrochloride
RN: 115041-69-5
InChIKey: UYCCXHZRLDSTCN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-O3-S.Cl-H

Molecular Weight

  • 452.016
 
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Names and Synonyms

Synonym

  • N-(4-((3-(4-(Phenylmethyl)-1-piperazinyl)propyl)sulfonyl)phenyl)acetamide monohydrochloride

Systematic Name

  • Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperazinyl)propyl)sulfonyl)phenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 115041-69-5

System Generated Number

  • 0115041695

Molecular Formulas

Molecular Formula

  • C22-H29-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C22-H29-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29N3O3S.ClH/c1-19(26)23-21-8-10-22(11-9-21)29(27,28)17-5-12-24-13-15-25(16-14-24)18-20-6-3-2-4-7-20;/h2-4,6-11H,5,12-18H2,1H3,(H,23,26);1H

InChIKey

UYCCXHZRLDSTCN-UHFFFAOYSA-N

Smiles

CC(=O)Nc1ccc(cc1)S(=O)(=O)CCCN2CCN(CC2)Cc3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 681mg/kg (681mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 26, Pg. 761, 1987.