Vitas-M small molecule compound
(2E)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide
Catalog ID
STK183207
SMILES N#C/C(=C\c1cc2OCOc2cc1Br)/C(=O)Nc1ccc(cc1)F
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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 C17H10BrFN2O3 MW 389.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10BrFN2O3/c18-14-7-16-15(23-9-24-16)6-10(14)5-11(8-20)17(22)21-13-3-1-12(19)2-4-13/h1-7H,9H2,(H,21,22)/b11-5+InChIKey
MSDIMGNHVXMUAI-VZUCSPMQSA-NSynonyms
(2E)3(6BROMO13BENZODIOXOL5YL)2CYANON(4FLUOROPHENYL)PROP2ENAMIDE
(E)3(6BROMO13BENZODIOXOL5YL)2CYANON(4FLUOROPHENYL)PROP2ENAMIDE
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)F)Br
InChI=1SC17H10BrFN2O3c181471615(2392416)610(14)511(820)17(22)21133112(19)2413h17H9H2(H2122)b115+
MFCD02379459
N#CC(=Cc1cc2OCOc2cc1Br)C(=O)Nc1ccc(cc1)F
ZINC000001192036
ZINC01192036
ZINC1192036
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