Vitas-M small molecule compound
2-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-ethoxyphenolate
Catalog ID
STK563817
SMILES CCOc1cccc(c1[O-])/C=N/NC(=O)CSc1[nH+]nc(n1c1ccc(cc1)Cl)c1ccc(cc1)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 C26H24ClN5O3S MW 522.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN5O3S/c1-3-35-22-6-4-5-19(24(22)34)15-28-29-23(33)16-36-26-31-30-25(18-9-7-17(2)8-10-18)32(26)21-13-11-20(27)12-14-21/h4-15,34H,3,16H2,1-2H3,(H,29,33)/b28-15+InChIKey
OTQUHAPEVUIXIU-RWPZCVJISA-NSynonyms
489413-84-52((E)(2(((4(4chlorophenyl)5(4methylphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6ethoxyphenolate
CCOc1cccc(c1(O))C=NNC(=O)CSc1(nH+)nc(n1c1ccc(cc1)Cl)c1ccc(cc1)C
MFCD03220240
ZINC000002252575
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