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N-Desmethyl Enzalutamide-[d6]

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General Information
Catalog: BLP-006054
Molecular Formula: C20H8D6F4N4O2S
Molecular Weight: 456.45

Chemical Structure

Description	N-Desmethyl Enzalutamide-[d6] is the labelled analogue of N-Desmethyl Enzalutamide, which is an impurity of Enzalutamide. Enzalutamide is an androgen-receptor (AR) antagonist in LNCaP cells.
Synonyms	N-Desmethyl Enzalutamide-d6; 4-[3-[4-Cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-fluorobenzamide-d6
IUPAC Name	4-[3-[4-cyano-3-(trifluoromethyl)phenyl]-4-oxo-2-sulfanylidene-5,5-bis(trideuteriomethyl)imidazolidin-1-yl]-2-fluorobenzamide
Related CAS	1242137-16-1 (unlabelled)
Canonical SMILES	CC1(C(=O)N(C(=S)N1C2=CC(=C(C=C2)C(=O)N)F)C3=CC(=C(C=C3)C#N)C(F)(F)F)C
InChI	InChI=1S/C20H14F4N4O2S/c1-19(2)17(30)27(11-4-3-10(9-25)14(7-11)20(22,23)24)18(31)28(19)12-5-6-13(16(26)29)15(21)8-12/h3-8H,1-2H3,(H2,26,29)/i1D3,2D3
InChI Key	JSFOGZGIBIQRPU-WFGJKAKNSA-N
Purity	98% HPLC
Appearance	Brown Solid
Storage	Store at 2-8°C