Vitas-M small molecule compound
2-{(E)-[2-({[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-(prop-2-en-1-yl)phenolate
Catalog ID
STL046223
SMILES C=CCc1cccc(c1[O-])/C=N/NC(=O)CSc1[nH+]nc(n1c1ccccc1)c1ccc(cc1)Cl
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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 C26H22ClN5O2S MW 504.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O2S/c1-2-7-18-8-6-9-20(24(18)34)16-28-29-23(33)17-35-26-31-30-25(19-12-14-21(27)15-13-19)32(26)22-10-4-3-5-11-22/h2-6,8-16,34H,1,7,17H2,(H,29,33)/b28-16+InChIKey
QLLDKSIBRXKALX-LQKURTRISA-NSynonyms
306757-91-52((E)(2(((5(4chlorophenyl)4phenyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6(prop2en1yl)phenolate
306757915
MFCD01586838
ZINC000002193793
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