Products 66981-77-9

CAS 66981-77-9 appears in our catalog under these names: Tianeptine Impurity 2(Tianeptine EP Impurity B), Tianeptine Ethyl Ester, >95% (HPLC), Tianeptine ethyl ester, Tianeptine EP Impurity B Fumarate. Offered by: Hubei YoungXin, TRC, Biosynth, Chemat Brand. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg, on request.

Structural formula: {0} (CAS {1})

Ethyl 7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]heptanoate (CAS 66981-77-9) is a chemical compound with the molecular formula C23H29ClN2O4S and a molecular weight of 465.0 g/mol. IUPAC name: ethyl 7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]heptanoate. InChIKey: FEFUFMZSNHPQDX-UHFFFAOYSA-N.

Identity
Molecular formulaC23H29ClN2O4S
Molecular weight465.0 g/mol
IUPAC nameethyl 7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]heptanoate
InChIKeyFEFUFMZSNHPQDX-UHFFFAOYSA-N
SMILESCCOC(=O)CCCCCCNC1C2=C(C=C(C=C2)Cl)S(=O)(=O)N(C3=CC=CC=C13)C

Computed by PubChem (NCBI)