Products 1803005-18-6

CAS 1803005-18-6 is the registry number for Tofacitinib HCl. Offered by: TargetMol. Available pack sizes: 25mg, 50mg, 100mg.

Structural formula: {0} (CAS {1})

3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile;hydrochloride (CAS 1803005-18-6) is a chemical compound with the molecular formula C16H21ClN6O and a molecular weight of 348.8 g/mol. IUPAC name: 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile;hydrochloride. InChIKey: GAAYSQZMMCUMRF-YLAFAASESA-N.

Identity
Molecular formulaC16H21ClN6O
Molecular weight348.8 g/mol
IUPAC name3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile;hydrochloride
InChIKeyGAAYSQZMMCUMRF-YLAFAASESA-N
SMILESC[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N.Cl

Computed by PubChem (NCBI)