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Substance Name: Ethanamine, 2-((6,11-dihydro-6-methyldibenzo(c,f)thiazepin-11-yl)oxy)-N-methyl-, 5,5-dioxide(Z)-2-butenedioate (1:1)
RN: 155444-07-8
InChIKey: HAKVMBUEJMNLIJ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-N2-O3-S.C4-H4-O4

Molecular Weight

  • 448.4936
 
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Names and Synonyms

  • Ethanamine, 2-((6,11-dihydro-6-methyldibenzo(c,f)thiazepin-11-yl)oxy)-N-methyl-, 5,5-dioxide(Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 155444-07-8

System Generated Number

  • 0155444078

Molecular Formulas

Molecular Formula

  • C17-H20-N2-O3-S.C4-H4-O4

Molecular Formula Fragments

  • C17-H20-N2-O3-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H20N2O3S.C4H4O4/c1-18-11-12-22-17-13-7-3-5-9-15(13)19(2)23(20,21)16-10-6-4-8-14(16)17;5-3(6)1-2-4(7)8/h3-10,17-18H,11-12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

HAKVMBUEJMNLIJ-WLHGVMLRSA-N

Smiles

CNCCOC1c2ccccc2N(S(=O)(=O)c3c1cccc3)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 321mg/kg (321mg/kg)   Archiv der Pharmazie Vol. 327, Pg. 157, 1994.