Vitas-M small molecule compound

N'-[(E)-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide

Catalog ID
STK548722
SMILES CCOc1cc(/C=N/NC(=O)Cn2nc(cc2C)[N+](=O)[O-])ccc1OCc1ccc(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 C22H22FN5O5 MW 455.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN5O5/c1-3-32-20-11-17(6-9-19(20)33-14-16-4-7-18(23)8-5-16)12-24-25-22(29)13-27-15(2)10-21(26-27)28(30)31/h4-12H,3,13-14H2,1-2H3,(H,25,29)/b24-12+
InChIKey
XIGPUWVJUIJLKO-WYMPLXKRSA-N
Synonyms
477763-43-2
(5METHYL3NITROPYRAZOL1YL)ACETICACID(1(3ETHOXY4(4FLUOROBENZYLOXY)PHENYL)METH(E)YLIDENE)HYDRAZIDE
(E)N(3ethoxy4((4fluorobenzyl)oxy)benzylidene)2(5methyl3nitro1Hpyrazol1yl)acetohydrazide
477763432
CCOC1=C(C=CC(=C1)C=NNC(=O)CN2C(=CC(=N2)(N+)(=O)(O))C)OCC3=CC=C(C=C3)F
CCOc1cc(C=NNC(=O)Cn2nc(cc2C)(N+)(=O)(O))ccc1OCc1ccc(cc1)F
InChI=1SC22H22FN5O5c1332201117(6919(20)3314164718(23)8516)12242522(29)132715(2)1021(2627)28(30)31h412H31314H212H3(H2529)b2412+
MFCD02834472
N((E)(3ethoxy4((4fluorobenzyl)oxy)phenyl)methylidene)2(5methyl3nitro1Hpyrazol1yl)acetohydrazide
N((E)(3ETHOXY4((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)2(5METHYL3NITROPYRAZOL1YL)ACETAMIDE
ZINC000002311592
ZINC33352734

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Available files

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