Vitas-M small molecule compound
(2E)-3-{2-bromo-4-[(2-cyanobenzyl)oxy]-5-methoxyphenyl}-2-cyano-N-(4-fluorophenyl)prop-2-enamide
Catalog ID
STK325180
SMILES N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccccc1C#N)/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 C25H17BrFN3O3 MW 506.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrFN3O3/c1-32-23-11-18(10-19(14-29)25(31)30-21-8-6-20(27)7-9-21)22(26)12-24(23)33-15-17-5-3-2-4-16(17)13-28/h2-12H,15H2,1H3,(H,30,31)/b19-10+InChIKey
VZROIHLWGFLSMI-VXLYETTFSA-NSynonyms
(2E)3(2BROMO4((2CYANOBENZYL)OXY)5METHOXYPHENYL)2CYANON(4FLUOROPHENYL)PROP2ENAMIDE
(E)3(2bromo4((2cyanophenyl)methoxy)5methoxyphenyl)2cyanoN(4fluorophenyl)prop2enamide
COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)F)Br)OCC3=CC=CC=C3C#N
InChI=1SC25H17BrFN3O3c132231118(1019(1429)25(31)30218620(27)7921)22(26)1224(23)331517532416(17)1328h212H15H21H3(H3031)b1910+
MFCD02196783
N#CC(=Cc1cc(OC)c(cc1Br)OCc1ccccc1C#N)C(=O)Nc1ccc(cc1)F
ZINC000018173398
ZINC18173398
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