Vitas-M small molecule compound
methyl {5-bromo-4-[(E)-{2-[(4-cyano-2-fluorophenyl)carbonyl]hydrazinylidene}methyl]-2-methoxyphenoxy}acetate
Catalog ID
STK198080
SMILES COC(=O)COc1cc(Br)c(cc1OC)/C=N/NC(=O)c1ccc(cc1F)C#N
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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 C19H15BrFN3O5 MW 464.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrFN3O5/c1-27-16-6-12(14(20)7-17(16)29-10-18(25)28-2)9-23-24-19(26)13-4-3-11(8-22)5-15(13)21/h3-7,9H,10H2,1-2H3,(H,24,26)/b23-9+InChIKey
GJDPIFFSAWOFLC-NUGSKGIGSA-NSynonyms
COC(=O)COc1cc(Br)c(cc1OC)C=NNC(=O)c1ccc(cc1F)C#N
COC1=C(C=C(C(=C1)C=NNC(=O)C2=C(C=C(C=C2)C#N)F)Br)OCC(=O)OC
InChI=1SC19H15BrFN3O5c12716612(14(20)717(16)291018(25)282)9232419(26)134311(822)515(13)21h379H10H212H3(H2426)b239+
METHYL(5BROMO4((E)(2((4CYANO2FLUOROPHENYL)CARBONYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
METHYL2(4((1E)2((4CYANO2FLUOROPHENYL)CARBONYLAMINO)2AZAVINYL)5BROMO2METHOXYPHENOXY)ACETATE
methyl2(5bromo4((E)((4cyano2fluorobenzoyl)hydrazinylidene)methyl)2methoxyphenoxy)acetate
MFCD03848973
ZINC000009323110
ZINC33667070
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