Vitas-M small molecule compound
4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-methoxyphenolate
Catalog ID
STL050315
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)[N+](=O)[O-])c2nonc2[NH3+])ccc1[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 C19H15N9O6 MW 465.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N9O6/c1-33-14-8-10(2-7-13(14)29)9-21-23-19(30)15-16(11-3-5-12(6-4-11)28(31)32)27(26-22-15)18-17(20)24-34-25-18/h2-9,29H,1H3,(H2,20,24)(H,23,30)/b21-9+InChIKey
LCKHEZHFIPWJDN-ZVBGSRNCSA-NSynonyms
843632-35-9843632359
COc1cc(C=NNC(=O)c2nnn(c2c2ccc(cc2)(N+)(=O)(O))c2nonc2(NH3+))ccc1(O)
MFCD03171305
ZINC000001869039
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