Products 2197189-31-2

CAS 2197189-31-2 is the registry number for Ticagrelor Impurity 3. Offered by: Chemat Brand. Available pack sizes: on request.

Ticagrelor Impurity 3
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

2-[[(3aR,4S,6R,6aS)-6-[(5-amino-6-chloro-2-propylsulfinylpyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol (CAS 2197189-31-2) is a chemical compound with the molecular formula C17H27ClN4O5S and a molecular weight of 434.9 g/mol. IUPAC name: 2-[[(3aR,4S,6R,6aS)-6-[(5-amino-6-chloro-2-propylsulfinylpyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol. InChIKey: HFEBEZQGNCEOSD-SNGXDLRTSA-N.

Identity
Molecular formulaC17H27ClN4O5S
Molecular weight434.9 g/mol
IUPAC name2-[[(3aR,4S,6R,6aS)-6-[(5-amino-6-chloro-2-propylsulfinylpyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol
InChIKeyHFEBEZQGNCEOSD-SNGXDLRTSA-N
SMILESCCCS(=O)C1=NC(=C(C(=N1)Cl)N)N[C@@H]2C[C@@H]([C@@H]3[C@H]2OC(O3)(C)C)OCCO

Computed by PubChem (NCBI)

Synonyms: C17H27ClN4O5S, orb3181506, Ticagrelor Impurity 76 (Mixture of Diastereomers)