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N-Acetyl-S-[4-(2-pyridinyl)benzyl]-L-cysteine-[d3]

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General Information
Catalog: BLP-006438
CAS: 1795785-71-5
Molecular Formula: C17H15D3N2O3S
Molecular Weight: 333.42

Chemical Structure

Description	N-Acetyl-S-[4-(2-pyridinyl)benzyl]-L-cysteine-[d3] is the labelled analogue of N-Acetyl-S-[4-(2-pyridinyl)benzyl]-L-cysteine, which is a metabolite of Atazanavir.
Synonyms	N-(Acetyl-d3)-S-[4-(2-pyridinyl)benzyl]-L-cysteine
IUPAC Name	(2R)-3-[(4-pyridin-2-ylphenyl)methylsulfanyl]-2-[(2,2,2-trideuterioacetyl)amino]propanoic acid
Related CAS	1391068-09-9 (unlabelled)
Canonical SMILES	CC(=O)NC(CSCC1=CC=C(C=C1)C2=CC=CC=N2)C(=O)O
InChI	InChI=1S/C17H18N2O3S/c1-12(20)19-16(17(21)22)11-23-10-13-5-7-14(8-6-13)15-4-2-3-9-18-15/h2-9,16H,10-11H2,1H3,(H,19,20)(H,21,22)/t16-/m0/s1/i1D3
InChI Key	XZBPUXNKKKMWON-AVSFSGARSA-N
Purity	≥98%
Storage	Store at -20°C