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Substance Name: Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperazinyl)propyl)thio)phenyl)-
RN: 115030-32-5
InChIKey: YRRXUWBBGMNNRL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-O-S

Molecular Weight

  • 383.5571
 
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Names and Synonyms

Synonyms

  • 1-(4-Benzylpiperazin-1-yl)-3-(4-acetamidophenylthio)propane
  • BRN 5140456
  • N-(4-((3-(4-(Phenylmethyl)-1-piperazinyl)propyl)thio)phenyl)acetamide

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 115030-32-5

System Generated Number

  • 0115030325

Structure Descriptors

InChI

1S/C22H29N3OS/c1-19(26)23-21-8-10-22(11-9-21)27-17-5-12-24-13-15-25(16-14-24)18-20-6-3-2-4-7-20/h2-4,6-11H,5,12-18H2,1H3,(H,23,26)

InChIKey

YRRXUWBBGMNNRL-UHFFFAOYSA-N

Smiles

CC(=O)Nc1ccc(cc1)SCCCN2CCN(CC2)Cc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 147mg/kg (147mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 26, Pg. 761, 1987.