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Substance Name: 1-Propanamine, N,N-dimethyl-3-(4H-thieno(2,3-b)(1)benzothiopyran-4-ylidene)-, (R-(R*,R*))-2,3-dihydroxybutanedioate, hydrate (1:1:2)
RN: 55407-80-2
InChIKey: ATZQCGICKWVDLG-DMRHMIGZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N-S2.C4-H6-O6.2H2-O

Molecular Weight

  • 437.5347
 
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Names and Synonyms

Synonym

  • 4-(3-Dimethylaminopropylidene)thieno(2,3-b)-1-benzothiopyran hydrogen tartrate dihydrate

Systematic Name

  • 1-Propanamine, N,N-dimethyl-3-(4H-thieno(2,3-b)(1)benzothiopyran-4-ylidene)-, (R-(R*,R*))-2,3-dihydroxybutanedioate, hydrate (1:1:2)

Registry Numbers

CAS Registry Number

  • 55407-80-2

System Generated Number

  • 0055407802

Molecular Formulas

Molecular Formula

  • C16-H17-N-S2.C4-H6-O6.2H2-O

Molecular Formula Fragments

  • C16-H17-N-S2
  • C4-H6-O6
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C16H17NS2.C4H6O6/c1-17(2)10-5-7-12-13-6-3-4-8-15(13)19-16-14(12)9-11-18-16;5-1(3(7)8)2(6)4(9)10/h3-4,6-9,11H,5,10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/b12-7+;/t;1-,2-/m.1/s1

InChIKey

ATZQCGICKWVDLG-DMRHMIGZSA-N

Smiles

CN(C)CC/C=C/1\c2ccccc2Sc3c1ccs3.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 72mg/kg (72mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 39, Pg. 1366, 1974.