Vitas-M small molecule compound
2-{(E)-[2-({4-[(4-bromophenyl)sulfonyl]piperazin-1-ium-1-yl}acetyl)hydrazinylidene]methyl}-6-ethoxyphenolate
Catalog ID
STL045866
SMILES CCOc1cccc(c1[O-])/C=N/NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
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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 C21H25BrN4O5S MW 525.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25BrN4O5S/c1-2-31-19-5-3-4-16(21(19)28)14-23-24-20(27)15-25-10-12-26(13-11-25)32(29,30)18-8-6-17(22)7-9-18/h3-9,14,28H,2,10-13,15H2,1H3,(H,24,27)/b23-14+InChIKey
BZMAXPOZOHOYBZ-OEAKJJBVSA-NSynonyms
488824-60-8488824608
CCOc1cccc(c1(O))C=NNC(=O)C(NH+)1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
MFCD03091376
ZINC000100856359
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.