Vitas-M small molecule compound

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

Catalog ID
STL149915
SMILES CCOc1cc(/C=N/NC(=O)CSc2[nH+]nc(n2C2CCCCC2)c2ccc(cc2)Cl)ccc1[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 C25H28ClN5O3S MW 514.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN5O3S/c1-2-34-22-14-17(8-13-21(22)32)15-27-28-23(33)16-35-25-30-29-24(18-9-11-19(26)12-10-18)31(25)20-6-4-3-5-7-20/h8-15,20,32H,2-7,16H2,1H3,(H,28,33)/b27-15+
InChIKey
OBRPVRPMISDUEK-JFLMPSFJSA-N
Synonyms
488717-88-0
4((E)(2(((5(4chlorophenyl)4cyclohexyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)2ethoxyphenolate
488717880
MFCD03221019

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Available files

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