Vitas-M small molecule compound
2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-{3-[(4-nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Catalog ID
STK079078
SMILES COCc1c(C#N)c(OCC(=O)N/N=C/c2cccc(c2)OCc2ccc(cc2)[N+](=O)[O-])nc(c1Br)C
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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 C25H22BrN5O6 MW 568.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN5O6/c1-16-24(26)22(14-35-2)21(11-27)25(29-16)37-15-23(32)30-28-12-18-4-3-5-20(10-18)36-13-17-6-8-19(9-7-17)31(33)34/h3-10,12H,13-15H2,1-2H3,(H,30,32)/b28-12+InChIKey
KSOGGRIPVOZVGB-KVSWJAHQSA-NSynonyms
2((5BROMO3CYANO4(METHOXYMETHYL)6METHYLPYRIDIN2YL)OXY)N((E)(3((4NITROBENZYL)OXY)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
2(5bromo3cyano4(methoxymethyl)6methylpyridin2yl)oxyN((E)(3((4nitrophenyl)methoxy)phenyl)methylideneamino)acetamide
CC1=C(C(=C(C(=N1)OCC(=O)NN=CC2=CC(=CC=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))C#N)COC)Br
COCc1c(C#N)c(OCC(=O)NN=Cc2cccc(c2)OCc2ccc(cc2)(N+)(=O)(O))nc(c1Br)C
InChI=1SC25H22BrN5O6c11624(26)22(14352)21(1127)25(2916)371523(32)3028121843520(1018)3613176819(9717)31(33)34h31012H1315H212H3(H3032)b2812+
MFCD01133620
STK079078
ZINC000100176800
ZINC101480077
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