Vitas-M small molecule compound

3-(ethylsulfanyl)-4-(4-fluorophenyl)-5-phenyl-4H-1,2,4-triazole

Catalog ID
STL375443
SMILES CCSc1nnc(n1c1ccc(cc1)F)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 C16H14FN3S MW 299.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14FN3S/c1-2-21-16-19-18-15(12-6-4-3-5-7-12)20(16)14-10-8-13(17)9-11-14/h3-11H,2H2,1H3
InChIKey
YZKOOVRSCCIFLE-UHFFFAOYSA-N
Synonyms

3(ethylsulfanyl)4(4fluorophenyl)5phenyl4H124triazole
3ETHYLSULFANYL4(4FLUOROPHENYL)5PHENYL124TRIAZOLE
CCSC1=NN=C(N1C2=CC=C(C=C2)F)C3=CC=CC=C3
InChI=1SC16H14FN3Sc122116191815(126435712)20(16)1410813(17)91114h311H2H21H3
MFCD03998177
ZINC000000470699
ZINC00470699
ZINC470699

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Available files

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