Quetiapine Dimer Impurity

Analyte Name

Quetiapine Dimer Impurity

CAS Number

945668-94-0

Molecular Formula

C30 H24 N4 S2

Molecular Weight

504.67

Accurate Mass

504.1442

SMILES

C1CN(CCN1C2=NC3=CC=CC=C3SC4=CC=CC=C42)C5=NC6=CC=CC=C6SC7=CC=CC=C75

InChI

InChI=1S/C30H24N4S2/c1-5-13-25-21(9-1)29(31-23-11-3-7-15-27(23)35-25)33-17-19-34(20-18-33)30-22-10-2-6-14-26(22)36-28-16-8-4-12-24(28)32-30/h1-16H,17-20H2

IUPAC

6-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)benzo[b][1,4]benzothiazepine

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Quetiapine; Quetiapine Fumarate

Purity

>95% (HPLC)