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Tofacitinib Impurity 29

SZ CAT No SZ-T010082
CAS No NA
Mol.F. C21H27N7O3
Mol.Wt. 425.5
Inv. Status Custom Synthesis


Chemical Name: Ethyl (E)-3-amino-2-cyano-5-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-5-oxopent-2-enoate

Smiles: CN([C@H]1CN(C(C/C(N)=C(C(OCC)=O)/C#N)=O)CC[C@H]1C)C2=C3C(NC=C3)=NC=N2

Inchi: InChI=1S/C18H19N3O5S/c1-2-3-10-8-27-17-13(16(24)21(17)14(10)18(25)26)20-15(23)12(19)9-4-6-11(22)7-5-9/h2-8,12-14,17,22H,19H2,1H3,(H,20,23)(H,25,26)/b3-2-/t12-,13-,14?,17-/m1/s1