Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-Isoquinolinamine, N-(3,4,4a,5-tetrahydro-1H-(1,3)-thiazino(3,4-a)indol-1-ylidene)-, (+-)-
RN: 76953-85-0
InChIKey: OXOIREPEMSQEFB-LSDHQDQOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H17-N3-S

Molecular Weight

  • 331.4413
 
* 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

  • (+-)-N-(3,4,4a,5-Tetrahydro-1H-(1,3)-thiazino(3,4-a)indol-1-ylidene)-5-isoquinolinamine
  • (RS)-4-(Isoquinol-5-ylimino)-1,2,10,10a-tetrahydro(1,3-thiazino)(3,4-a)indole

Systematic Name

  • 5-Isoquinolinamine, N-(3,4,4a,5-tetrahydro-1H-(1,3)-thiazino(3,4-a)indol-1-ylidene)-, (+-)-

Registry Numbers

CAS Registry Number

  • 76953-85-0

System Generated Number

  • 0076953850

Structure Descriptors

InChI

1S/C20H17N3S/c1-2-4-19-15(3-1)12-18-8-10-24-20(23(18)19)22-17-6-5-16-13-21-9-7-14(16)11-17/h1-7,9,11,13,18H,8,10,12H2/b22-20+

InChIKey

OXOIREPEMSQEFB-LSDHQDQOSA-N

Smiles

c1ccc2c(c1)CC3N2/C(=N\c4ccc5cnccc5c4)/SCC3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 900mg/kg (900mg/kg)   United States Patent Document. Vol. #4261993,