Seroquel

Molecular Formula: C₄₆H₅₄N₆O₈S₂

InChI: InChI=1/2C21H25N3O2S.C4H4O4/c2*25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21;5-3(6)1-2-4(7)8/h2*1-8,25H,9-16H2;1-2H,(H,5,6)(H,7,8)/b;;2-1+/f/h;;5,7H

InChIKey: InChIKey=ZTHJULTYCAQOIJ-CUAZGTLEDG
SMILES: C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C(=CC(=O)O)C(=O)O

Names:
    D00458
    Quetiapine fumarate (JAN/USAN)
    Quetiapine fumarate
    Seroquel (TN)
    Seroquel
    111974-72-2

Registries:
    PubChem CID 5281025
    PubChem ID 7847524