Vitas-M small molecule compound
2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenolate
Catalog ID
STL054869
SMILES CCCc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cccc(c1[O-])OC
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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/c1-3-5-10-12(19-23-24(10)15-14(17)21-28-22-15)16(26)20-18-8-9-6-4-7-11(27-2)13(9)25/h4,6-8,25H,3,5H2,1-2H3,(H2,17,21)(H,20,26)/b18-8+InChIKey
CJNLVCASUQYANI-QGMBQPNBSA-NSynonyms
861120-70-9861120709
CCCc1c(nnn1c1nonc1(NH3+))C(=O)NN=Cc1cccc(c1(O))OC
MFCD05683297
ZINC000001866780
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