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Ozanimod-[d7]

General Information
Catalog: BLP-015223
CAS: 2020381-02-4
Molecular Formula: C23H17D7N4O3
Molecular Weight: 411.51
Chemical Structure
Ozanimod-[d7]
Description Ozanimod-[d7] is a deuterium labelled Ozanimod which is a selective sphingosine 1-phosphate (S1P) receptor modulator.
Synonyms Ozanimod-d7; (S)-5-(3-(1-((2-Hydroxyethyl)amino)-2,3-dihydro-1H-inden-4-yl)-1,2,4-oxadiazol-5-yl)-2-((propan-2-yl-d7)oxy)benzonitrile
IUPAC Name 2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yloxy)-5-[3-[(1S)-1-(2-hydroxyethylamino)-2,3-dihydro-1H-inden-4-yl]-1,2,4-oxadiazol-5-yl]benzonitrile
Related CAS 1306760-87-1 (unlabelled)
Canonical SMILES [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])OC1=C(C=C(C=C1)C2=NC(=NO2)C3=C4CC[C@@H](C4=CC=C3)NCCO)C#N
InChI InChI=1S/C23H24N4O3/c1-14(2)29-21-9-6-15(12-16(21)13-24)23-26-22(27-30-23)19-5-3-4-18-17(19)7-8-20(18)25-10-11-28/h3-6,9,12,14,20,25,28H,7-8,10-11H2,1-2H3/t20-/m0/s1/i1D3,2D3,14D
InChI Key XRVDGNKRPOAQTN-BQQZAVLCSA-N

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