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o-Toluoyl-5-hydroxy Omeprazole Sulfide-[d3]

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General Information
Catalog: BLP-003693
CAS: 1276635-87-0
Molecular Formula: C25H22D3N3O4S
Molecular Weight: 466.57

Chemical Structure

Description	o-Toluoyl-5-hydroxy Omeprazole Sulfide-[d3], is an isotope labelled derivative of o-Toluoyl-5-hydroxy Omeprazole Sulfide, which is an intermediate of omeprazole metabolites.
Synonyms	o-Toluoyl-5-hydroxy Omeprazole Sulfide D3
IUPAC Name	[4-methoxy-5-methyl-6-[[6-(trideuteriomethoxy)-1H-benzimidazol-2-yl]sulfanylmethyl]pyridin-3-yl]methyl 2-methylbenzoate
Related CAS	120003-78-3 (unlabelled)
Canonical SMILES	CC1=CC=CC=C1C(=O)OCC2=CN=C(C(=C2OC)C)CSC3=NC4=C(N3)C=C(C=C4)OC
InChI	InChI=1S/C25H25N3O4S/c1-15-7-5-6-8-19(15)24(29)32-13-17-12-26-22(16(2)23(17)31-4)14-33-25-27-20-10-9-18(30-3)11-21(20)28-25/h5-12H,13-14H2,1-4H3,(H,27,28)/i3D3
InChI Key	LQJIZEQSBXNIDM-HPRDVNIFSA-N
Boiling Point	660.9±65.0°C at 760 mmHg
Density	1.3±0.1 g/cm3
Solubility	Soluble in Dichloromethane, Methanol
Appearance	Brown Oil
Storage	Store at 2-8°C