Vitas-M small molecule compound
2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenolate
Catalog ID
STL048335
SMILES COc1cccc(c1[O-])/C=N/NC(=O)c1nnn(c1CSc1ccc(cc1)C)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 C21H20N8O4S MW 480.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O4S/c1-12-6-8-14(9-7-12)34-11-15-17(24-28-29(15)20-19(22)26-33-27-20)21(31)25-23-10-13-4-3-5-16(32-2)18(13)30/h3-10,30H,11H2,1-2H3,(H2,22,26)(H,25,31)/b23-10+InChIKey
UIZWCEXYDWGYAZ-AUEPDCJTSA-NSynonyms
861645-48-9861645489
COc1cccc(c1(O))C=NNC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1(NH3+)
MFCD05686210
ZINC000001900565
Check stock
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Check stock on Vitas-MAvailable files
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