Vitas-M small molecule compound
(2-{(E)-[2-({[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetate
Catalog ID
STL045259
SMILES COc1ccc(cc1)c1n[nH+]c(n1c1ccc(cc1)C)SCC(=O)N/N=C/c1ccccc1OCC(=O)[O-]
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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 C27H25N5O5S MW 531.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O5S/c1-18-7-11-21(12-8-18)32-26(19-9-13-22(36-2)14-10-19)30-31-27(32)38-17-24(33)29-28-15-20-5-3-4-6-23(20)37-16-25(34)35/h3-15H,16-17H2,1-2H3,(H,29,33)(H,34,35)/b28-15+InChIKey
VPLPNQQDXFLIAL-RWPZCVJISA-NSynonyms
496797-61-6(2((E)(2(((5(4methoxyphenyl)4(4methylphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenoxy)acetate
496797616
COc1ccc(cc1)c1n(nH+)c(n1c1ccc(cc1)C)SCC(=O)NN=Cc1ccccc1OCC(=O)(O)
MFCD03220482
ZINC000002304593
Check stock
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Check stock on Vitas-MAvailable files
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