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Hydroxyfenbendazole-[methyl-d3] monohydrate

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General Information
Catalog: BLP-005913
CAS: 1596379-07-5
Molecular Formula: C15H12D3N3O4S
Molecular Weight: 336.38

Chemical Structure

Description	Hydroxyfenbendazole-[methyl-d3] monohydrate is a labelled analogue of Hydroxyfenbendazole monohydrate, which is used as a radiolabelled internal standard.
Synonyms	N-[6-[(4-Hydroxyphenyl)thio]-1H-benzimidazol-2-yl]carbamic acid methyl-d3 ester monohydrate; Hydroxyfenbendazole-D3 hydrate;
IUPAC Name	trideuteriomethyl N-[6-(4-hydroxyphenyl)sulfanyl-1H-benzimidazol-2-yl]carbamate;hydrate
Related CAS	1584701-11-0 (unlabelled)
Canonical SMILES	COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=C(C=C3)O.O
InChI	InChI=1S/C15H13N3O3S.H2O/c1-21-15(20)18-14-16-12-7-6-11(8-13(12)17-14)22-10-4-2-9(19)3-5-10;/h2-8,19H,1H3,(H2,16,17,18,20);1H2/i1D3;
InChI Key	JFFKWYDCSIKODM-NIIDSAIPSA-N