Vitas-M small molecule compound
2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenolate
Catalog ID
STK567725
SMILES COc1cccc(c1[O-])/C=N/NC(=O)c1nnn(c1C(C)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 C16H18N8O4 MW 386.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N8O4/c1-8(2)12-11(19-23-24(12)15-14(17)21-28-22-15)16(26)20-18-7-9-5-4-6-10(27-3)13(9)25/h4-8,25H,1-3H3,(H2,17,21)(H,20,26)/b18-7+InChIKey
QWXANWQBAUZPQB-CNHKJKLMSA-NSynonyms
586991-52-8586991528
COc1cccc(c1(O))C=NNC(=O)c1nnn(c1C(C)C)c1nonc1(NH3+)
MFCD04031185
ZINC000002394153
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