Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Propanamine, 3-dibenzo(b,e)thiepin-11(6H)-ylidene-, (E)-, (Z)-2-butenedioate (1:1)
RN: 73149-98-1
InChIKey: IVMXLIIUYSVZSC-BZDXOQGASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N-S.C4-H4-O4

Molecular Weight

  • 383.4659
 
* 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

Synonyms

  • (E)-3-Dibenzo(b,e)thiepin-11(6H)-ylidene-1-propanamine
  • trans-11-(3-Aminopropylidene)-6,11-dihydrodibenzo(b,e)thiepin maleate
  • VUFB-13.770

Systematic Name

  • 1-Propanamine, 3-dibenzo(b,e)thiepin-11(6H)-ylidene-, (E)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 73149-98-1

System Generated Number

  • 0073149981

Molecular Formulas

Molecular Formula

  • C17-H17-N-S.C4-H4-O4

Molecular Formula Fragments

  • C17-H17-N-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H17NS.C4H4O4/c18-11-5-9-15-14-7-2-1-6-13(14)12-19-17-10-4-3-8-16(15)17;5-3(6)1-2-4(7)8/h1-4,6-10H,5,11-12,18H2;1-2H,(H,5,6)(H,7,8)/b15-9+;2-1+

InChIKey

IVMXLIIUYSVZSC-BZDXOQGASA-N

Smiles

NCC\C=C\1/c2ccccc2CSc3ccccc13.OC(=O)\C=C\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 400mg/kg (400mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 44, Pg. 2536, 1979.