Vitas-M small molecule compound
2-{(E)-[(3,5-dimethyl-4H-1,2,4-triazol-1-ium-4-yl)imino]methyl}-6-(prop-2-en-1-yl)phenolate
Catalog ID
STL047032
SMILES C=CCc1cccc(c1[O-])/C=N/n1c(C)n[nH+]c1C
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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 C14H16N4O MW 256.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O/c1-4-6-12-7-5-8-13(14(12)19)9-15-18-10(2)16-17-11(18)3/h4-5,7-9,19H,1,6H2,2-3H3/b15-9+InChIKey
QHERJVGZDPKCLM-OQLLNIDSSA-NSynonyms
307327-90-82((E)((35dimethyl4H124triazol1ium4yl)imino)methyl)6(prop2en1yl)phenolate
307327908
C=CCc1cccc(c1(O))C=Nn1c(C)n(nH+)c1C
MFCD01910196
ZINC000000228479
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