Tofacitinib Impurity 93

cas: 1616761-01-3 — see every product listed under this CAS number, including other names

Tofacitinib Impurity 93 (CAS 1616761-01-3) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-T060393
cas1616761-01-3
sizeon request
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Structural formula: {0} (CAS {1})

Methyl 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanoate (CAS 1616761-01-3) is a chemical compound with the molecular formula C17H23N5O3 and a molecular weight of 345.4 g/mol. IUPAC name: methyl 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanoate. InChIKey: MBBWHWXFWMYUEZ-YPMHNXCESA-N.

Identity
Molecular formulaC17H23N5O3
Molecular weight345.4 g/mol
IUPAC namemethyl 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanoate
InChIKeyMBBWHWXFWMYUEZ-YPMHNXCESA-N
SMILESC[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC(=O)OC

Computed by PubChem (NCBI)

Synonyms: Tofacitinib Impurity 93
Isomers (same molecular formula)
1-methoxy-4-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]cyclohexane-1-carboxylic acid C17H23N5O3

Also listed as

Methyl 3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanoate, 95% Chemat Brand CAS 1616761-01-3
Tofacitinib Impurity 68 Hubei YoungXin CAS 1616761-01-3