Vitas-M small molecule compound

methyl (2Z)-[2-(2-chlorophenyl)hydrazinylidene][(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Catalog ID
STK997311
SMILES COC(=O)/C(=N/Nc1ccccc1Cl)/Sc1nnc(n1c1ccccc1)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 C23H18ClN5O2S MW 463.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN5O2S/c1-31-22(30)21(27-25-19-15-9-8-14-18(19)24)32-23-28-26-20(16-10-4-2-5-11-16)29(23)17-12-6-3-7-13-17/h2-15,25H,1H3/b27-21-
InChIKey
BEFYJFHEIFDEDD-MEFGMAGPSA-N
Synonyms
669761-25-5
(Z)methyl2(2(2chlorophenyl)hydrazono)2((45diphenyl4H124triazol3yl)thio)acetate
669761255
COC(=O)C(=NNC1=CC=CC=C1Cl)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
COC(=O)C(=NNc1ccccc1Cl)Sc1nnc(n1c1ccccc1)c1ccccc1
InChI=1SC23H18ClN5O2Sc13122(30)21(27251915981418(19)24)3223282620(16104251116)29(23)17126371317h21525H1H3b2721
methyl(2Z)(2(2chlorophenyl)hydrazinylidene)((45diphenyl4H124triazol3yl)sulfanyl)ethanoate
METHYL(2Z)2((2CHLOROPHENYL)HYDRAZINYLIDENE)2((45DIPHENYL124TRIAZOL3YL)SULFANYL)ACETATE
MFCD03672136
ZINC000002205244
ZINC33350344

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Available files

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