Chemical Compound

Tofacitinib

CAS Registry Number 477600-75-2
Tofacitinib chemical structure
Primary Record

Tofacitinib

In stock
6,318 g
Purity
98.9 %
CAS
477600-75-2

Compound Identifiers & Properties

CAS
477600-75-2
PubChem CID
134129621
SMILES
CC1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N
Canonical SMILES
CC1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12

Names & Synonyms

  • Tofacitinib
  • C16H20N6O
  • MFCD11035919
  • 477600-75-2
  • 3-[(3S,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
  • 3-[(3R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-1-piperidyl]-3-oxo-propanenitrile
  • 3-[(3R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile