Vitas-M small molecule compound
methyl 2-chloro-5-{5-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STL388298
SMILES COC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C\1/C(=O)NN(C1=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 C22H15ClN2O5 MW 422.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN2O5/c1-29-22(28)16-11-13(7-9-18(16)23)19-10-8-15(30-19)12-17-20(26)24-25(21(17)27)14-5-3-2-4-6-14/h2-12H,1H3,(H,24,26)/b17-12-InChIKey
LKGCZRGNKQYAJG-ATVHPVEESA-NSynonyms
COC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)Cl
COC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1C(=O)NN(C1=O)c1ccccc1
InChI=1SC22H15ClN2O5c12922(28)161113(7918(16)23)1910815(3019)121720(26)2425(21(17)27)145324614h212H1H3(H2426)b1712
MFCD01158425
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