Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetamide, N-(10,11-dihydro-10-(4-methyl-1-piperazinyl)dibenzo(b,f)thiepin-2-yl)-, dimethanesulfonate
RN: 58721-93-0
InChIKey: JHEZFECQOHVUPL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N3-O-S.2C-H4-O3-S

Molecular Weight

  • 559.7257
 
* 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

Synonym

  • 2-Acetamido-10-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin bis(methanesulfonate)

Systematic Name

  • Acetamide, N-(10,11-dihydro-10-(4-methyl-1-piperazinyl)dibenzo(b,f)thiepin-2-yl)-, dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 58721-93-0

System Generated Number

  • 0058721930

Molecular Formulas

Molecular Formula

  • C21-H25-N3-O-S.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C21-H25-N3-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25N3OS.2CH4O3S/c1-15(25)22-17-7-8-20-16(13-17)14-19(24-11-9-23(2)10-12-24)18-5-3-4-6-21(18)26-20;2*1-5(2,3)4/h3-8,13,19H,9-12,14H2,1-2H3,(H,22,25);2*1H3,(H,2,3,4)

InChIKey

JHEZFECQOHVUPL-UHFFFAOYSA-N

Smiles

CC(=O)Nc1ccc2c(c1)CC(c3ccccc3S2)N4CCN(CC4)C.CS(=O)(=O)O.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 190mg/kg (190mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 2649, 1975.