Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(4-bromo-2-fluorophenyl)prop-2-enamide
Catalog ID
STK078236
SMILES O=C(Nc1ccc(cc1F)Br)/C=C/c1ccc2c(c1)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 C16H11BrFNO3 MW 364.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrFNO3/c17-11-3-4-13(12(18)8-11)19-16(20)6-2-10-1-5-14-15(7-10)22-9-21-14/h1-8H,9H2,(H,19,20)/b6-2+InChIKey
ZREDKKJKEFLTEG-QHHAFSJGSA-NSynonyms
349578-05-8(2E)3(13BENZODIOXOL5YL)N(4BROMO2FLUOROPHENYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(4BROMO2FLUOROPHENYL)PROP2ENAMIDE
349578058
C1OC2=C(O1)C=C(C=C2)C=CC(=O)NC3=C(C=C(C=C3)Br)F
InChI=1SC16H11BrFNO3c17113413(12(18)811)1916(20)6210151415(710)2292114h18H9H2(H1920)b62+
MFCD02242836
O=C(Nc1ccc(cc1F)Br)C=Cc1ccc2c(c1)OCO2
STK078236
ZINC000000671425
ZINC00671425
ZINC671425
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