Vitas-M small molecule compound
2-{(E)-[2-({[4-(4-bromophenyl)-5-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-(prop-2-en-1-yl)phenolate
Catalog ID
STL147763
SMILES C=CCc1cccc(c1[O-])/C=N/NC(=O)CSc1[nH+]nc(n1c1ccc(cc1)Br)c1ccccc1
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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 C26H22BrN5O2S MW 548.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22BrN5O2S/c1-2-7-18-10-6-11-20(24(18)34)16-28-29-23(33)17-35-26-31-30-25(19-8-4-3-5-9-19)32(26)22-14-12-21(27)13-15-22/h2-6,8-16,34H,1,7,17H2,(H,29,33)/b28-16+InChIKey
QZADVNWMHXUJKU-LQKURTRISA-NSynonyms
488854-59-72((E)(2(((4(4bromophenyl)5phenyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6(prop2en1yl)phenolate
488854597
C=CCc1cccc(c1(O))C=NNC(=O)CSc1(nH+)nc(n1c1ccc(cc1)Br)c1ccccc1
MFCD03218129
ZINC000002695893
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