Vitas-M small molecule compound
4-{(E)-[2-({1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2-ethoxyphenolate
Catalog ID
STL041970
SMILES CCOc1cc(/C=N/NC(=O)c2nnn(c2CSc2ccccc2)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 C21H20N8O4S MW 480.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O4S/c1-2-32-17-10-13(8-9-16(17)30)11-23-25-21(31)18-15(12-34-14-6-4-3-5-7-14)29(28-24-18)20-19(22)26-33-27-20/h3-11,30H,2,12H2,1H3,(H2,22,26)(H,25,31)/b23-11+InChIKey
ZJSLDLSNRBKYFM-FOKLQQMPSA-NSynonyms
843620-58-6843620586
CCOc1cc(C=NNC(=O)c2nnn(c2CSc2ccccc2)c2nonc2(NH3+))ccc1(O)
MFCD04015417
ZINC000001875981
Check stock
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Check stock on Vitas-MAvailable files
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