Vitas-M small molecule compound
(2E)-3-{4-[(4-bromobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-(4-fluorophenyl)prop-2-enamide
Catalog ID
STK325235
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccc(cc1)Br)/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 C24H18BrFN2O3 MW 481.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrFN2O3/c1-30-23-13-17(4-11-22(23)31-15-16-2-5-19(25)6-3-16)12-18(14-27)24(29)28-21-9-7-20(26)8-10-21/h2-13H,15H2,1H3,(H,28,29)/b18-12+InChIKey
YTVNVYKUTDVKCL-LDADJPATSA-NSynonyms
(2E)3(4((4BROMOBENZYL)OXY)3METHOXYPHENYL)2CYANON(4FLUOROPHENYL)PROP2ENAMIDE
(E)3(4((4bromophenyl)methoxy)3methoxyphenyl)2cyanoN(4fluorophenyl)prop2enamide
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)F)OCC3=CC=C(C=C3)Br
InChI=1SC24H18BrFN2O3c130231317(41122(23)3115162519(25)6316)1218(1427)24(29)28219720(26)81021h213H15H21H3(H2829)b1812+
MFCD02196804
N#CC(=Cc1ccc(c(c1)OC)OCc1ccc(cc1)Br)C(=O)Nc1ccc(cc1)F
ZINC000018173412
ZINC18173412
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