Vitas-M small molecule compound
(2E)-3-(3,5-dibromo-2-methoxyphenyl)-N-(4-fluoro-3-nitrophenyl)prop-2-enamide
Catalog ID
STK003343
SMILES COc1c(/C=C/C(=O)Nc2ccc(c(c2)[N+](=O)[O-])F)cc(cc1Br)Br
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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 C16H11Br2FN2O4 MW 474.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Br2FN2O4/c1-25-16-9(6-10(17)7-12(16)18)2-5-15(22)20-11-3-4-13(19)14(8-11)21(23)24/h2-8H,1H3,(H,20,22)/b5-2+InChIKey
SLRHQKLYGUZEEI-GORDUTHDSA-NSynonyms
(2E)3(35DIBROMO2METHOXYPHENYL)N(4FLUORO3NITROPHENYL)PROP2ENAMIDE
(E)3(35DIBROMO2METHOXYPHENYL)N(4FLUORO3NITROPHENYL)PROP2ENAMIDE
COC1=C(C=C(C=C1C=CC(=O)NC2=CC(=C(C=C2)F)(N+)(=O)(O))Br)Br
COc1c(C=CC(=O)Nc2ccc(c(c2)(N+)(=O)(O))F)cc(cc1Br)Br
InChI=1SC16H11Br2FN2O4c125169(610(17)712(16)18)2515(22)20113413(19)14(811)21(23)24h28H1H3(H2022)b52+
MFCD02187735
STK003343
ZINC000012285163
ZINC12285163
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