Vitas-M small molecule compound
2-ethoxy-4-[(E)-{2-[(3-methyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}methyl]phenyl benzoate
Catalog ID
STK249249
SMILES CCOc1cc(/C=N/NC(=O)c2[nH]nc(c2)C)ccc1OC(=O)c1ccccc1
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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 C21H20N4O4 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4/c1-3-28-19-12-15(13-22-25-20(26)17-11-14(2)23-24-17)9-10-18(19)29-21(27)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H,23,24)(H,25,26)/b22-13+InChIKey
TTXOLVYQBSSEFD-LPYMAVHISA-NSynonyms
(2ethoxy4((E)((5methyl1Hpyrazole3carbonyl)hydrazinylidene)methyl)phenyl)benzoate
2ethoxy4((E)(2((3methyl1Hpyrazol5yl)carbonyl)hydrazinylidene)methyl)phenylbenzoate
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=NNC(=C2)C)OC(=O)C3=CC=CC=C3
CCOc1cc(C=NNC(=O)c2(nH)nc(c2)C)ccc1OC(=O)c1ccccc1
InChI=1SC21H20N4O4c1328191215(13222520(26)171114(2)232417)91018(19)2921(27)167546816h413H3H212H3(H2324)(H2526)b2213+
MFCD00651006
ZINC000005247623
ZINC98031199
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