Vitas-M small molecule compound

4-[(1E)-1-(2-{[4-(2-chlorobenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)ethyl]-2-methoxyphenolate

Catalog ID
STK560382
SMILES COc1cc(ccc1[O-])/C(=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccccc1Cl)/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 C22H27ClN4O3 MW 430.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClN4O3/c1-16(17-7-8-20(28)21(13-17)30-2)24-25-22(29)15-27-11-9-26(10-12-27)14-18-5-3-4-6-19(18)23/h3-8,13,28H,9-12,14-15H2,1-2H3,(H,25,29)/b24-16+
InChIKey
JRTZGABRUWKYMI-LFVJCYFKSA-N
Synonyms
315198-84-6
315198846
COc1cc(ccc1(O))C(=NNC(=O)C(NH+)1CCN(CC1)Cc1ccccc1Cl)C
MFCD02075437
ZINC000096077900

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Available files

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