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Substance Name: 1H-Dibenzo(2,3:6,7)thiepino(4,5-b)pyrrolium, 2,3,3a,12b-tetrahydro-11-chloro-1,1-dimethyl-, chloride, hydrate
RN: 62715-13-3
InChIKey: YOMVXIZLLCLPHE-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-Cl-N-S.Cl.H2-O

Molecular Weight

  • 352.3271
 
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Names and Synonyms

  • 1H-Dibenzo(2,3:6,7)thiepino(4,5-b)pyrrolium, 2,3,3a,12b-tetrahydro-11-chloro-1,1-dimethyl-, chloride, hydrate

Registry Numbers

CAS Registry Number

  • 62715-13-3

System Generated Number

  • 0062715133

Molecular Formulas

Molecular Formula

  • C18-H19-Cl-N-S.Cl.H2-O

Molecular Formula Fragments

  • C18-H19-Cl-N-S
  • Cl
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C18H19ClNS.ClH/c1-20(2)10-9-14-13-5-3-4-6-16(13)21-17-8-7-12(19)11-15(17)18(14)20;/h3-8,11,14,18H,9-10H2,1-2H3;1H/q+1;/p-1

InChIKey

YOMVXIZLLCLPHE-UHFFFAOYSA-M

Smiles

C[N+]1(CCC2C1c3cc(ccc3Sc4c2cccc4)Cl)C.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4mg/kg (4mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 3420, 1976.