Vitas-M small molecule compound
5-[(4-bromo-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-4,5-dihydro-1,2-oxazole
Catalog ID
STK692762
SMILES COc1c(CC2ON=C(C2)c2ccc(cc2)F)c(Br)c2c(c1OC)OCO2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H17BrFNO5 MW 438.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrFNO5/c1-23-16-13(15(20)17-19(18(16)24-2)26-9-25-17)7-12-8-14(22-27-12)10-3-5-11(21)6-4-10/h3-6,12H,7-9H2,1-2H3InChIKey
JZANKHVWXBAVAG-UHFFFAOYSA-NSynonyms
5((4bromo67dimethoxy13benzodioxol5yl)methyl)3(4fluorophenyl)45dihydro12oxazole
COC1=C(C(=C2C(=C1OC)OCO2)Br)CC3CC(=NO3)C4=CC=C(C=C4)F
InChI=1SC19H17BrFNO5c1231613(15(20)1719(18(16)242)2692517)712814(222712)103511(21)6410h3612H79H212H3
MFCD10038780
ZINC000015084713
ZINC000015084716
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