Vitas-M small molecule compound

2-(prop-2-en-1-yl)-6-[(E)-(4H-1,2,4-triazol-3-ylimino)methyl]phenol

Catalog ID
STL151594
SMILES Oc1c(/C=N/c2nnc[nH]2)cccc1CC=C

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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 C12H12N4O MW 228.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O/c1-2-4-9-5-3-6-10(11(9)17)7-13-12-14-8-15-16-12/h2-3,5-8,17H,1,4H2,(H,14,15,16)/b13-7+
InChIKey
OJTNMXIZFRXHDR-NTUHNPAUSA-N
Synonyms
372179-21-0
(E)2(((1H124triazol3yl)imino)methyl)6allylphenol
2(prop2en1yl)6((E)(4H124triazol3ylimino)methyl)phenol
372179210
C=CCc1cccc(c1O)C=Nc1n(nH)cn1
MFCD20756043
Oc1c(C=Nc2nnc(nH)2)cccc1CC=C
ZINC000018164790

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.