Vitas-M small molecule compound

4-[(2-chloro-6-ethoxy-4-{(Z)-[2-(5-nitropyridin-2-yl)hydrazinylidene]methyl}phenoxy)methyl]benzoic acid

Catalog ID
STK197963
SMILES CCOc1cc(/C=N\Nc2ccc(cn2)[N+](=O)[O-])cc(c1OCc1ccc(cc1)C(=O)O)Cl

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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 C22H19ClN4O6 MW 470.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O6/c1-2-32-19-10-15(11-25-26-20-8-7-17(12-24-20)27(30)31)9-18(23)21(19)33-13-14-3-5-16(6-4-14)22(28)29/h3-12H,2,13H2,1H3,(H,24,26)(H,28,29)/b25-11-
InChIKey
UPXLHSQUBISSHO-GATIEOLUSA-N
Synonyms

4((2CHLORO6ETHOXY4((Z)((5NITROPYRIDIN2YL)HYDRAZINYLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
4((2CHLORO6ETHOXY4((Z)(2(5NITROPYRIDIN2YL)HYDRAZINYLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
4((4((1Z)2((5NITRO(2PYRIDYL))AMINO)2AZAVINYL)2CHLORO6ETHOXYPHENOXY)METHYL)BENZOICACID
CCOC1=C(C(=CC(=C1)C=NNC2=NC=C(C=C2)(N+)(=O)(O))Cl)OCC3=CC=C(C=C3)C(=O)O
CCOc1cc(C=NNc2ccc(cn2)(N+)(=O)(O))cc(c1OCc1ccc(cc1)C(=O)O)Cl
InChI=1SC22H19ClN4O6c1232191015(112526208717(122420)27(30)31)918(23)21(19)3313143516(6414)22(28)29h312H213H21H3(H2426)(H2829)b2511
MFCD03550324
ZINC000030809257
ZINC96860863

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Available files

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