Quetiapine 3D structure

Quetiapine (also called quetiapina, Norsic) has the formula C21H25N3O2S and a molar mass of 383.5 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula
C21H25N3O2S
Molar mass
383.5 g/mol
PubChem CID
5002
Heavy atoms
27
Category
Common drugs

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol
SMILESC1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42
PubChem CID5002
Other namesquetiapina, Norsic, quetiapinum, Quetiapine extended release, Seroquel XL

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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