Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 7-Oxa-3-thia-1-azaspiro(5.5)undec-1-en-2-amine, (+-)-, (Z)-2-butenedioate (1:1)
RN: 51270-20-3
InChIKey: CABGNVDGOPAPID-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H14-N2-O-S.C4-H4-O4

Molecular Weight

  • 302.3492
 
* 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-Amino-7-oxa-3-thia-1-azaspiro(5.5)undec-1-ene maleate

Systematic Name

  • 7-Oxa-3-thia-1-azaspiro(5.5)undec-1-en-2-amine, (+-)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 51270-20-3

System Generated Number

  • 0051270203

Molecular Formulas

Molecular Formula

  • C8-H14-N2-O-S.C4-H4-O4

Molecular Formula Fragments

  • C4-H4-O4
  • C8-H14-N2-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C8H14N2OS.C4H4O4/c9-7-10-8(4-6-12-7)3-1-2-5-11-8;5-3(6)1-2-4(7)8/h1-6H2,(H2,9,10);1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

CABGNVDGOPAPID-WLHGVMLRSA-N

Smiles

C1CCOC2(C1)CCSC(=N2)N.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 33mg/kg (33mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 895, 1978.
mouse LD50 oral 120mg/kg (120mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 895, 1978.