Chemical Compound

Quetiapine fumarate

CAS Registry Number 111974-72-2
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Quetiapine fumarate chemical structure
Primary Record

Quetiapine fumarate

In stock
3,348 g
Purity
99.8 %
CAS
111974-72-2

Compound Identifiers & Properties

CAS
111974-72-2
PubChem CID
45358180
SMILES
C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C(=C\C(=O)O)\C(=O)O
Canonical SMILES
O=C(O)/C=C\C(=O)O.OCCOCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1.OCCOCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1

Names & Synonyms

  • Quetiapine fumarate
  • Seroquel
  • Seroquel XR
  • Quetiapine Fumarate?
  • H-LEU-VAL-OH
  • UNII-2S3PL1B6UJ
  • Quetiapine fumarate [USAN]
  • ZD5077
  • ICI 204636
  • ICI 204,636
  • BC216603
  • ZM 204636
  • ZM 204,636
  • 111974-72-2
  • (C21-H25-N3-O2-S)2.C4-H4-O4
  • 2-(2-(4-Dibenzo(b,f)(1,4)thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol