Vitas-M small molecule compound
2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenolate
Catalog ID
STK568427
SMILES COc1cccc(c1[O-])/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1[NH3+]
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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 C19H15N9O6 MW 465.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N9O6/c1-33-13-4-2-3-11(16(13)29)9-21-23-19(30)14-15(10-5-7-12(8-6-10)28(31)32)27(26-22-14)18-17(20)24-34-25-18/h2-9,29H,1H3,(H2,20,24)(H,23,30)/b21-9+InChIKey
OXBVEDAGAKYYBJ-ZVBGSRNCSA-NSynonyms
840486-06-8840486068
COc1cccc(c1(O))C=NNC(=O)c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1(NH3+)
MFCD04007737
ZINC000001876987
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