Tianeptine Metabolite MC5 Sodium Salt

CAS: 115220-11-6

Ref. TR-T436810

Product Information

• Name: Tianeptine Metabolite MC5 Sodium Salt
• Synonyms: Pentanoic acid, 5-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-, sodium salt (1:1), Pentanoic acid, 5-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-, monosodium salt (9CI), Pentanoic acid, 5-[(3-chloro-6,11-dihydro-6-methyldibenzo[c,f][1,2]thiazepin-11-yl)amino]-, S,S-dioxide, monosodium salt, Dibenzo[c,f][1,2]thiazepine, pentanoic acid deriv.
• Brand: TRC
• Description: Applications Primary metabolite of Tianeptine.References Dresse, A., et al.: J. Clin. Pharmacol., 28, 1115 (1988), Grislain, L., et al.: Drug Metab. Dispos., 18, 804 (1990),

Chemical properties

• Molecular weight: 430.88
• Formula: C₁₉H₂₀ClN₂O₄S·Na
• Color/Form: Neat
• InChI: InChI=1S/C19H21ClN2O4S.Na/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;/h2-3,6-7,9-10,12,19,21H,4-5,8,11H2,1H3,(H,23,24);/q;+1/p-1
• InChI key: InChIKey=GBYSEZGRQUELJJ-UHFFFAOYSA-M
• SMILES: CN1c2ccccc2C(NCCCCC(=O)O[Na])c2ccc(Cl)cc2S1(=O)=O