Vitas-M small molecule compound
(2E)-3-{3-bromo-4-[(3-nitrobenzyl)oxy]phenyl}-2-(4-fluorophenyl)prop-2-enenitrile
Catalog ID
STK200936
SMILES N#C/C(=C/c1ccc(c(c1)Br)OCc1cccc(c1)[N+](=O)[O-])/c1ccc(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 C22H14BrFN2O3 MW 453.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14BrFN2O3/c23-21-12-15(10-18(13-25)17-5-7-19(24)8-6-17)4-9-22(21)29-14-16-2-1-3-20(11-16)26(27)28/h1-12H,14H2/b18-10-InChIKey
QZBOELZJHGEMLX-ZDLGFXPLSA-NSynonyms
(2E)3(3BROMO4((3NITROBENZYL)OXY)PHENYL)2(4FLUOROPHENYL)PROP2ENENITRILE
(E)3(3BROMO4((3NITROPHENYL)METHOXY)PHENYL)2(4FLUOROPHENYL)PROP2ENENITRILE
C1=CC(=CC(=C1)(N+)(=O)(O))COC2=C(C=C(C=C2)C=C(C#N)C3=CC=C(C=C3)F)Br
InChI=1SC22H14BrFN2O3c23211215(1018(1325)175719(24)8617)4922(21)29141621320(1116)26(27)28h112H14H2b1810
MFCD06001741
N#CC(=Cc1ccc(c(c1)Br)OCc1cccc(c1)(N+)(=O)(O))c1ccc(cc1)F
ZINC000002871158
ZINC02871158
ZINC2871158
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