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Diltiazem-[d6]

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General Information
Catalog: BLP-005166
CAS: 1242184-41-3
Molecular Formula: C22H20D6N2O4S
Molecular Weight: 420.56

Chemical Structure

Description	Diltiazem-[d6] is a deuterium labelled form of Diltiazem. Diltiazem is a calcium channel blocker medication used to treat high blood pressure, angina, and certain heart arrhythmias.
Synonyms	Diltiazem D6; (2S,3S)-5-(2-{Bis[(2H3)methyl]amino}ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
IUPAC Name	[(2S,3S)-5-[2-[bis(trideuteriomethyl)amino]ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate
Related CAS	42399-41-7 (unlabelled) 1309283-34-8 (hydrochloride)
Canonical SMILES	CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC
InChI	InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1/i2D3,3D3
InChI Key	HSUGRBWQSSZJOP-NFBMDBORSA-N
Melting Point	97-99°C
Purity	98% by CP; 98% atom D
Solubility	Soluble in Chloroform, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C, Under inert atmosphere