Vitas-M small molecule compound

2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate

Catalog ID
STK568026
SMILES O=C(c1nnn(c1C(C)C)c1nonc1[NH3+])N/N=C/c1ccccc1[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 C15H16N8O3 MW 356.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N8O3/c1-8(2)12-11(18-22-23(12)14-13(16)20-26-21-14)15(25)19-17-7-9-5-3-4-6-10(9)24/h3-8,24H,1-2H3,(H2,16,20)(H,19,25)/b17-7+
InChIKey
WDKYXIOLTLDWHL-REZTVBANSA-N
Synonyms
578721-57-0
578721570
MFCD04029708
O=C(c1nnn(c1C(C)C)c1nonc1(NH3+))NN=Cc1ccccc1(O)
ZINC000002389444

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.