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Thiorphan 5-Methoxyacetophenone-[d5] Sodium

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General Information
Catalog: BLP-007423
Molecular Formula: C21H17D5NNaO5S
Molecular Weight: 428.49

Chemical Structure

Description	Thiorphan 5-Methoxyacetophenone-[d5] Sodium is a labelled derivative of Thiorphan.
Synonyms	2-(2-benzyl D5-3-((2-(3-methoxyphenyl)-2-oxoethyl)thio)propanamidm salt
IUPAC Name	sodium;2-[[2-[[2-(3-methoxyphenyl)-2-oxoethyl]sulfanylmethyl]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoyl]amino]acetate
Related CAS	1398044-41-1 (free base)
Canonical SMILES	COC1=CC=CC(=C1)C(=O)CSCC(CC2=CC=CC=C2)C(=O)NCC(=O)[O-].[Na+]
InChI	InChI=1S/C21H23NO5S.Na/c1-27-18-9-5-8-16(11-18)19(23)14-28-13-17(21(26)22-12-20(24)25)10-15-6-3-2-4-7-15;/h2-9,11,17H,10,12-14H2,1H3,(H,22,26)(H,24,25);/q;+1/p-1/i2D,3D,4D,6D,7D;
InChI Key	FNEMNFPTDWPKEO-MKCOZUEUSA-M
Purity	>98%