Vitas-M small molecule compound
2-methylpropyl 4-({5-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-methoxybenzyl}oxy)benzoate
Catalog ID
STK546107
SMILES COc1ccc(cc1COc1ccc(cc1)C(=O)OCC(C)C)/C=N/NC(=O)c1nnn(c1C)c1nonc1N
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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 C26H28N8O6 MW 548.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N8O6/c1-15(2)13-39-26(36)18-6-8-20(9-7-18)38-14-19-11-17(5-10-21(19)37-4)12-28-30-25(35)22-16(3)34(33-29-22)24-23(27)31-40-32-24/h5-12,15H,13-14H2,1-4H3,(H2,27,31)(H,30,35)/b28-12+InChIKey
OBTFPMFAKLIDLN-KVSWJAHQSA-NSynonyms
499211-70-0(E)isobutyl4((5((2(1(4amino125oxadiazol3yl)5methyl1H123triazole4carbonyl)hydrazono)methyl)2methoxybenzyl)oxy)benzoate
2methylpropyl4((5((E)((1(4amino125oxadiazol3yl)5methyltriazole4carbonyl)hydrazinylidene)methyl)2methoxyphenyl)methoxy)benzoate
2methylpropyl4((5((E)(2((1(4amino125oxadiazol3yl)5methyl1H123triazol4yl)carbonyl)hydrazinylidene)methyl)2methoxybenzyl)oxy)benzoate
499211700
CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)C(=O)OCC(C)C
COc1ccc(cc1COc1ccc(cc1)C(=O)OCC(C)C)C=NNC(=O)c1nnn(c1C)c1nonc1N
InChI=1SC26H28N8O6c115(2)133926(36)186820(9718)3814191117(51021(19)374)12283025(35)2216(3)34(332922)2423(27)31403224h51215H1314H214H3(H22731)(H3035)b2812+
MFCD03303868
ZINC000100900876
ZINC102443591
Check stock
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Check stock on Vitas-MAvailable files
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