Tofacitinib Impurity 18

cas: 2028267-73-2 — see every product listed under this CAS number, including other names

Tofacitinib Impurity 18 (CAS 2028267-73-2) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-T060343
cas2028267-73-2
sizeon request
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Structural formula: {0} (CAS {1})

N-[(3R,4R)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl]-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine oxide (CAS 2028267-73-2) is a chemical compound with the molecular formula C16H20N6O2 and a molecular weight of 328.37 g/mol. IUPAC name: N-[(3R,4R)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl]-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine oxide. InChIKey: BKXHGXXDZRQCDL-YZQUQHLXSA-N.

Identity
Molecular formulaC16H20N6O2
Molecular weight328.37 g/mol
IUPAC nameN-[(3R,4R)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl]-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine oxide
InChIKeyBKXHGXXDZRQCDL-YZQUQHLXSA-N
SMILESC[C@@H]1CCN(C[C@@H]1[N+](C)(C2=NC=NC3=C2C=CN3)[O-])C(=O)CC#N

Computed by PubChem (NCBI)

Synonyms: Tofacitinib Impurity 18, Tofacitinib Impurity 24, Tofacitinib N-oxide
Isomers (same molecular formula)
3-[(3R,4R)-3-[(7-hydroxypyrrolo[2,3-d]pyrimidin-4-yl)-methylamino]-4-methylpiperidin-1-yl]-3-oxopropanenitrile C16H20N6O2
3-[(3R,4R)-4-methyl-3-[methyl-(6-oxo-5,7-dihydropyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O2
3-[(3R,4R)-4-methyl-3-[methyl-(6-oxo-5,7-dihydropyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O2
3-[(3R,4R)-4-methyl-3-[methyl-(5-oxo-6,7-dihydropyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C16H20N6O2
[(1S,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]methyl acetate C16H20N6O2

Also listed as

Tofacitinib Impurity 33 Chemat Brand CAS 2028267-73-2
Tofacitinib N-Oxide Chemat Brand CAS 2028267-73-2
(R)-N-((3R,4R)-1-(2-Cyanoacetyl)-4-methylpiperidin-3-yl)-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine oxide, 95% Chemat Brand CAS 2028267-73-2
Tofacitinib Impurity 59 Hubei YoungXin CAS 2028267-73-2