Elagolix Impurity 25

cas: 1062642-68-5 — see every product listed under this CAS number, including other names

Elagolix Impurity 25 (CAS 1062642-68-5) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-E120125
cas1062642-68-5
sizeon request
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properties

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Structural formula: {0} (CAS {1})

Tert-butyl N-[(1R)-2-[5-(2-fluoro-3-hydroxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]carbamate (CAS 1062642-68-5) is a chemical compound with the molecular formula C32H30F5N3O5 and a molecular weight of 631.6 g/mol. IUPAC name: tert-butyl N-[(1R)-2-[5-(2-fluoro-3-hydroxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]carbamate. InChIKey: SOEZKYFWNCRHKZ-DEOSSOPVSA-N.

Identity
Molecular formulaC32H30F5N3O5
Molecular weight631.6 g/mol
IUPAC nametert-butyl N-[(1R)-2-[5-(2-fluoro-3-hydroxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]carbamate
InChIKeySOEZKYFWNCRHKZ-DEOSSOPVSA-N
SMILESCC1=C(C(=O)N(C(=O)N1CC2=C(C=CC=C2F)C(F)(F)F)C[C@@H](C3=CC=CC=C3)NC(=O)OC(C)(C)C)C4=C(C(=CC=C4)O)F

Computed by PubChem (NCBI)

Isomers (same molecular formula)
4-[[(1S)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid C32H30F5N3O5
4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid C32H30F5N3O5

Also listed as

Elagolix Impurity 27 Chemat Brand CAS 1062642-68-5