Vitas-M small molecule compound
4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2,6-dimethoxyphenolate
Catalog ID
STL050189
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2[NH3+])cc(c1[O-])OC
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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 C21H20N8O5 MW 464.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O5/c1-11-4-6-13(7-5-11)17-16(24-28-29(17)20-19(22)26-34-27-20)21(31)25-23-10-12-8-14(32-2)18(30)15(9-12)33-3/h4-10,30H,1-3H3,(H2,22,26)(H,25,31)/b23-10+InChIKey
ADRVDTIVFVYAHN-AUEPDCJTSA-NSynonyms
578755-14-3578755143
COc1cc(C=NNC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2(NH3+))cc(c1(O))OC
MFCD04024421
ZINC000001845856
Check stock
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Check stock on Vitas-MAvailable files
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