Products 91-33-8

CAS 91-33-8 appears in our catalog under these names: Benzthiazide, 95%, Benzthiazide, >95% (HPLC), Benzthiazide, Benzthiazide/ 99.34% (existing batch purity), Benzthiazide, 95%+, 95%+. Offered by: Combi-blocks, TRC, Mikromol, LoGiCal, TargetMol. Available pack sizes: 250mg, 100mg, 1g, 50mg, 5mg, 10mM (in 1ml dmso), 500mg, 500 mg.

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

Benzthiazide is 7-Sulfamoyl-1,2,4-benzothiadiazine 1,1-dioxide in which the hydrogen at position 6 is substituted by chlorine and that at position 3 is substituted by a benzylsulfanylmethyl group. A diuretic, it is used to treat hypertension and edema. It has a role as a diuretic and an antihypertensive agent. It is a sulfonamide and a benzothiadiazine.

Source: ChEBI

Identity
Molecular formulaC15H14ClN3O4S3
Molecular weight431.9 g/mol
IUPAC name3-(benzylsulfanylmethyl)-6-chloro-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazine-7-sulfonamide
InChIKeyNDTSRXAMMQDVSW-UHFFFAOYSA-N
SMILESC1=CC=C(C=C1)CSCC2=NS(=O)(=O)C3=CC(=C(C=C3N2)Cl)S(=O)(=O)N

Computed by PubChem (NCBI)