Products 131206-48-9

CAS 131206-48-9 appears in our catalog under these names: Tianeptine EP Impurity D, Tianeptine Impurity 4(Tianeptine EP Impurity D). Offered by: Chemat Brand, Hubei YoungXin. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.

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

7-[(3-chloro-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-ylidene)amino]heptanoic acid (CAS 131206-48-9) is a chemical compound with the molecular formula C21H23ClN2O4S and a molecular weight of 434.9 g/mol. IUPAC name: 7-[(3-chloro-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-ylidene)amino]heptanoic acid. InChIKey: MWEFWMXNBIQQNK-UHFFFAOYSA-N.

Identity
Molecular formulaC21H23ClN2O4S
Molecular weight434.9 g/mol
IUPAC name7-[(3-chloro-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-ylidene)amino]heptanoic acid
InChIKeyMWEFWMXNBIQQNK-UHFFFAOYSA-N
SMILESCN1C2=CC=CC=C2C(=NCCCCCCC(=O)O)C3=C(S1(=O)=O)C=C(C=C3)Cl

Computed by PubChem (NCBI)