Products 2415991-81-8

CAS 2415991-81-8 is the registry number for Sitagliptin Impurity 108. Offered by: Chemat Brand. Available pack sizes: on request.

Sitagliptin Impurity 108
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

(E)-4-oxo-4-[[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]amino]but-2-enoic acid (CAS 2415991-81-8) is a chemical compound with the molecular formula C20H17F6N5O4 and a molecular weight of 505.4 g/mol. IUPAC name: (E)-4-oxo-4-[[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]amino]but-2-enoic acid. InChIKey: LXMZRMNMEIKFSE-FMBMQGQPSA-N.

Identity
Molecular formulaC20H17F6N5O4
Molecular weight505.4 g/mol
IUPAC name(E)-4-oxo-4-[[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]amino]but-2-enoic acid
InChIKeyLXMZRMNMEIKFSE-FMBMQGQPSA-N
SMILESC1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)NC(=O)/C=C/C(=O)O

Computed by PubChem (NCBI)