Seroquel

Molecular Formula: C₂₉H₃₃N₃O₁₀S

InChI: InChI=1/C21H25N3O2S.2C4H4O4/c25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21;2*5-3(6)1-2-4(7)8/h1-8,25H,9-16H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+/f/h;2*5,7H

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

Names:
    Ethanol, 2-(2-(4-dibenzo(b,f)(1,4)thiazepin-11-yl-1-piperazinyl)ethoxy)-, (E)-2-butenedioate (2:1) (salt)
    ICI 204,636
    Quetiapine fumarate [USAN]
    Quetiapine fumarate
    Seroquel
    ZD5077
    ZM 204,636
    111974-72-2
    2-(2-(4-Dibenzo(b,f)(1,4)thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol

Registries:
    PubChem CID 6436253
    PubChem ID 215529