Vitas-M small molecule compound
2,4-dibromo-6-{(E)-[2-({[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Catalog ID
STL149544
SMILES COc1ccc(cc1)c1n[nH+]c(n1c1ccc(cc1)C)SCC(=O)N/N=C/c1cc(Br)cc(c1[O-])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 C25H21Br2N5O3S MW 631.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21Br2N5O3S/c1-15-3-7-19(8-4-15)32-24(16-5-9-20(35-2)10-6-16)30-31-25(32)36-14-22(33)29-28-13-17-11-18(26)12-21(27)23(17)34/h3-13,34H,14H2,1-2H3,(H,29,33)/b28-13+InChIKey
NECNRPGWNJOXCL-XODNFHPESA-NSynonyms
24dibromo6((E)(2(((5(4methoxyphenyl)4(4methylphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
COc1ccc(cc1)c1n(nH+)c(n1c1ccc(cc1)C)SCC(=O)NN=Cc1cc(Br)cc(c1(O))Br
MFCD03091223
ZINC000150391506
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