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Tofacitinib Trans Impurity

SZ CAT No SZ-T010096
CAS No NA
Mol.F. C16H20N6O
Mol.Wt. 312.4
Inv. Status Custom Synthesis


Chemical Name: 3-{(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl}-3-oxopropanenitrile and 3-{(3R,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl}-3-oxopropanenitrile

Smiles: N#CCC(N1C[C@@H](N(C)C2=C3C(NC=C3)=NC=N2)[C@H](C)CC1)=O.N#CCC(N4C[C@H](N(C)C5=C6C(NC=C6)=NC=N5)[C@@H](C)CC4)=O

Inchi: InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13)/i2D3