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rac Toltrazuril Sulfoxide-[d3]

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General Information
Catalog: BLP-004054
CAS: 1346603-43-7
Molecular Formula: C18H11D3F3O5S
Molecular Weight: 444.40

Chemical Structure

Description	Isotope labelled Toltrazuril sulfoxide is a metabolite of Toltrazuril. Toltrazuril is an antiprotazoal agent and could be used against Equine Protozoal Myeloencephalitis.
Synonyms	1-Methyl-3-[3-methyl-4-[4-[(trifluoromethyl)sulfinyl]phenoxy]phenyl]-1,3,5-triazine-2,4,6(1H,3H,5H)-trione-d3
IUPAC Name	1-[3-methyl-4-[4-(trifluoromethylsulfinyl)phenoxy]phenyl]-3-(trideuteriomethyl)-1,3,5-triazinane-2,4,6-trione
Related CAS	69004-15-5 (unlabelled)
Canonical SMILES	CC1=C(C=CC(=C1)N2C(=O)NC(=O)N(C2=O)C)OC3=CC=C(C=C3)S(=O)C(F)(F)F
InChI	InChI=1S/C18H14F3N3O5S/c1-10-9-11(24-16(26)22-15(25)23(2)17(24)27)3-8-14(10)29-12-4-6-13(7-5-12)30(28)18(19,20)21/h3-9H,1-2H3,(H,22,25,26)/i2D3
InChI Key	QWKYIPKCLAUFCM-BMSJAHLVSA-N