Vitas-M small molecule compound

2-methoxy-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
STK561302
SMILES COc1ccc(cc1)c1n[nH+]c(n1c1ccc(cc1)C)SCC(=O)N/N=C/c1cccc(c1[O-])OC

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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 C26H25N5O4S MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O4S/c1-17-7-11-20(12-8-17)31-25(18-9-13-21(34-2)14-10-18)29-30-26(31)36-16-23(32)28-27-15-19-5-4-6-22(35-3)24(19)33/h4-15,33H,16H2,1-3H3,(H,28,32)/b27-15+
InChIKey
BHYVCOZUHOJONT-JFLMPSFJSA-N
Synonyms
488110-40-3
2methoxy6((E)(2(((5(4methoxyphenyl)4(4methylphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
COc1ccc(cc1)c1n(nH+)c(n1c1ccc(cc1)C)SCC(=O)NN=Cc1cccc(c1(O))OC
MFCD03220484
ZINC000001474496

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.