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Substance Name: 5-Isoquinolinamine, 3-methyl-N-(3,4,4a,5-tetrahydro-1H-(1,3)thiazino(3,4-a)indol-1-ylidene)-, (+-)-
RN: 76953-83-8
InChIKey: POCGKVQKZZRAGH-XTQSDGFTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H19-N3-S

Molecular Weight

  • 345.4681
 
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Names and Synonyms

Synonym

  • (RS)-4-((3-Methylisoquinol-5-yl)imino)-1,2,10,10a-tetrahydro(1,3-thiazino)(3,4-a)indole

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 76953-83-8

System Generated Number

  • 0076953838

Structure Descriptors

InChI

1S/C21H19N3S/c1-14-10-17-11-18(7-6-16(17)13-22-14)23-21-24-19(8-9-25-21)12-15-4-2-3-5-20(15)24/h2-7,10-11,13,19H,8-9,12H2,1H3/b23-21+

InChIKey

POCGKVQKZZRAGH-XTQSDGFTSA-N

Smiles

Cc1cc2cc(ccc2cn1)/N=C/3\N4c5ccccc5CC4CCS3

Toxicity

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