Vitas-M small molecule compound

4-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate

Catalog ID
STL039941
SMILES O=C(CSc1[nH+]nc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/c1ccc(cc1)[O-]

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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 C24H20ClN5O2S MW 477.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN5O2S/c1-16-2-6-18(7-3-16)23-28-29-24(30(23)20-10-8-19(25)9-11-20)33-15-22(32)27-26-14-17-4-12-21(31)13-5-17/h2-14,31H,15H2,1H3,(H,27,32)/b26-14+
InChIKey
QLJLTECXBPGLCJ-VULFUBBASA-N
Synonyms
489401-48-1
4((E)(2(((4(4chlorophenyl)5(4methylphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
489401481
MFCD03220189
O=C(CSc1(nH+)nc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=Cc1ccc(cc1)(O)
ZINC000009272568

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Available files

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