Vitas-M small molecule compound
{4-[(E)-(2-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]acetyl}hydrazinylidene)methyl]-2-methoxyphenoxy}acetic acid
Catalog ID
STK374541
SMILES COc1cc(/C=N/NC(=O)Cn2c(nc3c2cccc3)c2nonc2N)ccc1OCC(=O)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 C21H19N7O6 MW 465.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N7O6/c1-32-16-8-12(6-7-15(16)33-11-18(30)31)9-23-25-17(29)10-28-14-5-3-2-4-13(14)24-21(28)19-20(22)27-34-26-19/h2-9H,10-11H2,1H3,(H2,22,27)(H,25,29)(H,30,31)/b23-9+InChIKey
YHSKZIFXGPLPJC-NUGSKGIGSA-NSynonyms
(4((E)(2((2(4amino125oxadiazol3yl)1Hbenzimidazol1yl)acetyl)hydrazinylidene)methyl)2methoxyphenoxy)aceticacid
2(4((E)((2(2(4amino125oxadiazol3yl)benzimidazol1yl)acetyl)hydrazinylidene)methyl)2methoxyphenoxy)aceticacid
COC1=C(C=CC(=C1)C=NNC(=O)CN2C3=CC=CC=C3N=C2C4=NON=C4N)OCC(=O)O
COc1cc(C=NNC(=O)Cn2c(nc3c2cccc3)c2nonc2N)ccc1OCC(=O)O
InChI=1SC21H19N7O6c13216812(6715(16)331118(30)31)9232517(29)102814532413(14)2421(28)1920(22)27342619h29H1011H21H3(H22227)(H2529)(H3031)b239+
MFCD01030043
ZINC000004044893
ZINC33921881
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