Vitas-M small molecule compound

2-methoxy-4-[(1E)-1-(2-{[4-(4-methylbenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)ethyl]phenolate

Catalog ID
STL149951
SMILES COc1cc(ccc1[O-])/C(=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccc(cc1)C)/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 C23H30N4O3 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O3/c1-17-4-6-19(7-5-17)15-26-10-12-27(13-11-26)16-23(29)25-24-18(2)20-8-9-21(28)22(14-20)30-3/h4-9,14,28H,10-13,15-16H2,1-3H3,(H,25,29)/b24-18+
InChIKey
WMXXVDYZWJDGKX-HKOYGPOVSA-N
Synonyms
497246-06-7
497246067
COc1cc(ccc1(O))C(=NNC(=O)C(NH+)1CCN(CC1)Cc1ccc(cc1)C)C
MFCD03222034
ZINC000020100160

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Available files

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