Vitas-M small molecule compound

5-(4-ethoxyphenyl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK600017
SMILES CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(F)(F)F

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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 C18H15F3N4OS MW 392.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F3N4OS/c1-2-26-15-9-5-13(6-10-15)16-23-24-17(27)25(16)22-11-12-3-7-14(8-4-12)18(19,20)21/h3-11H,2H2,1H3,(H,24,27)/b22-11+
InChIKey
JREUSZCGDVCTIB-SSDVNMTOSA-N
Synonyms
497950-32-0
497950320
CCOc1ccc(cc1)c1n(nH)c(=S)n1N=Cc1ccc(cc1)C(F)(F)F
MFCD07208698
ZINC000005900427

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Available files

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