Vitas-M small molecule compound

3-(difluoromethyl)-N-[(E)-(3-fluorophenyl)methylidene]-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STK965015
SMILES CSc1nnc(n1/N=C/c1cccc(c1)F)C(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 C11H9F3N4S MW 286.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9F3N4S/c1-19-11-17-16-10(9(13)14)18(11)15-6-7-3-2-4-8(12)5-7/h2-6,9H,1H3/b15-6+
InChIKey
GMYVDINXTQLPRH-GIDUJCDVSA-N
Synonyms
828275-83-8
(E)N(3(difluoromethyl)5methylsulfanyl124triazol4yl)1(3fluorophenyl)methanimine
3(difluoromethyl)N((E)(3fluorophenyl)methylidene)5(methylsulfanyl)4H124triazol4amine
828275838
CSC1=NN=C(N1N=CC2=CC(=CC=C2)F)C(F)F
CSc1nnc(n1N=Cc1cccc(c1)F)C(F)F
InChI=1SC11H9F3N4Sc11911171610(9(13)14)18(11)15673248(12)57h269H1H3b156+
MFCD04052671
ZINC000002789506
ZINC35678908

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Available files

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