Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,2-Ethanediamine, N-(6,11-dihydro-11-phenyldibenzo(b,e)thiepin-11-yl)-, (Z)-2-butenedioate (1:1)
RN: 84964-57-8
InChIKey: UJBYQUNBDIIRIK-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H22-N2-S.C4-H4-O4

Molecular Weight

  • 462.5674
 
* 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

  • 11-(2-Aminoethylamino)-11-phenyl-6,11-dihydrodibenzo(b,e)thiepin maleate

Systematic Name

  • 1,2-Ethanediamine, N-(6,11-dihydro-11-phenyldibenzo(b,e)thiepin-11-yl)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 84964-57-8

System Generated Number

  • 0084964578

Molecular Formulas

Molecular Formula

  • C22-H22-N2-S.C4-H4-O4

Molecular Formula Fragments

  • C22-H22-N2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H22N2S.C4H4O4/c23-14-15-24-22(18-9-2-1-3-10-18)19-11-5-4-8-17(19)16-25-21-13-7-6-12-20(21)22;5-3(6)1-2-4(7)8/h1-13,24H,14-16,23H2;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

UJBYQUNBDIIRIK-WLHGVMLRSA-N

Smiles

NCCNC1(c2ccccc2)c3ccccc3CSc4ccccc14.OC(=O)\C=C\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 47, Pg. 3094, 1982.