Products 2209488-73-1

CAS 2209488-73-1 is the registry number for Quetiapine Hemifumarate Ester. Offered by: TRC. Available pack sizes: 250mg.

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

4-[2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethoxy]-4-oxobut-2-enoic acid (CAS 2209488-73-1) is a chemical compound with the molecular formula C25H27N3O5S and a molecular weight of 481.6 g/mol. IUPAC name: 4-[2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethoxy]-4-oxobut-2-enoic acid. InChIKey: IJSBIBKELUJDFP-UHFFFAOYSA-N.

Identity
Molecular formulaC25H27N3O5S
Molecular weight481.6 g/mol
IUPAC name4-[2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethoxy]-4-oxobut-2-enoic acid
InChIKeyIJSBIBKELUJDFP-UHFFFAOYSA-N
SMILESC1CN(CCN1CCOCCOC(=O)C=CC(=O)O)C2=NC3=CC=CC=C3SC4=CC=CC=C42

Computed by PubChem (NCBI)