Vitas-M small molecule compound

2-[3-cyano-4-(methoxymethyl)-6-methyl-2-oxopyridin-1(2H)-yl]-N'-[(E)-{3-ethoxy-4-[(4-nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide

Catalog ID
STL388296
SMILES COCc1cc(C)n(c(=O)c1C#N)CC(=O)N/N=C/c1ccc(c(c1)OCC)OCc1ccc(cc1)[N+](=O)[O-]

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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 C27H27N5O7 MW 533.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O7/c1-4-38-25-12-20(7-10-24(25)39-16-19-5-8-22(9-6-19)32(35)36)14-29-30-26(33)15-31-18(2)11-21(17-37-3)23(13-28)27(31)34/h5-12,14H,4,15-17H2,1-3H3,(H,30,33)/b29-14+
InChIKey
UFAJJDGNFDCGCI-IPPBACCNSA-N
Synonyms

2(3cyano4(methoxymethyl)6methyl2oxopyridin1(2H)yl)N((E)(3ethoxy4((4nitrobenzyl)oxy)phenyl)methylidene)acetohydrazide
2(3cyano4(methoxymethyl)6methyl2oxopyridin1yl)N((E)(3ethoxy4((4nitrophenyl)methoxy)phenyl)methylideneamino)acetamide
CCOC1=C(C=CC(=C1)C=NNC(=O)CN2C(=CC(=C(C2=O)C#N)COC)C)OCC3=CC=C(C=C3)(N+)(=O)(O)
COCc1cc(C)n(c(=O)c1C#N)CC(=O)NN=Cc1ccc(c(c1)OCC)OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC27H27N5O7c1438251220(71024(25)3916195822(9619)32(35)36)14293026(33)153118(2)1121(17373)23(1328)27(31)34h51214H41517H213H3(H3033)b2914+
MFCD28951194
ZINC000105992172

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Available files

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