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Substance Name: Tianeptine MC(5)
RN: 104732-22-1
InChIKey: YYUMTPUPRWXCTH-UHFFFAOYSA-L

Note

  • MC5 metabolite of tianeptine.

Molecular Formula

  • C19-H21-Cl-N2-O4-S

Molecular Weight

  • 408.9039
 
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Names and Synonyms

Name of Substance

  • Tianeptine MC(5)

Synonym

  • MC(5) tianeptine

Systematic Name

  • Pentanoic acid, 5-((3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo(c,f)(1,2)thiazepin-11-yl)amino)-

Registry Numbers

CAS Registry Number

  • 104732-22-1

System Generated Number

  • 0104732221

Structure Descriptors

InChI

1S/C19H23ClN2O4S/c1-22-16-7-3-2-6-14(16)19(21-11-5-4-8-18(23)24)15-10-9-13(20)12-17(15)27(22,25)26/h2-3,6-7,9-10,12,19,21,25-26H,4-5,8,11H2,1H3,(H,23,24)/p-2

InChIKey

YYUMTPUPRWXCTH-UHFFFAOYSA-L

Smiles

CN1c2ccccc2C(c3ccc(cc3S1([O-])[O-])Cl)NCCCCC(=O)O