Products 2402776-80-9

CAS 2402776-80-9 is the registry number for Baricitinib Impurity 51. Offered by: Chemat Brand. Available pack sizes: on request.

Baricitinib Impurity 51
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

Methyl 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetate (CAS 2402776-80-9) is a chemical compound with the molecular formula C17H20N6O4S and a molecular weight of 404.4 g/mol. IUPAC name: methyl 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetate. InChIKey: VVULXZUNJSTDTG-UHFFFAOYSA-N.

Identity
Molecular formulaC17H20N6O4S
Molecular weight404.4 g/mol
IUPAC namemethyl 2-[1-ethylsulfonyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetate
InChIKeyVVULXZUNJSTDTG-UHFFFAOYSA-N
SMILESCCS(=O)(=O)N1CC(C1)(CC(=O)OC)N2C=C(C=N2)C3=C4C=CNC4=NC=N3

Computed by PubChem (NCBI)

Synonyms: Baricitinib Impurity N16
Isomers (same molecular formula)
ethyl N-[6-[3-(methanesulfonamido)-4-methylphenyl]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]carbamate C17H20N6O4S