Vitas-M small molecule compound

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

Catalog ID
STL176116
SMILES CSc1nnc(n1/N=C/c1ccc(s1)C)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 C10H10F2N4S2 MW 288.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10F2N4S2/c1-6-3-4-7(18-6)5-13-16-9(8(11)12)14-15-10(16)17-2/h3-5,8H,1-2H3/b13-5+
InChIKey
QRCISMUODXEBRO-WLRTZDKTSA-N
Synonyms
828275-24-7
(E)N(3(difluoromethyl)5methylsulfanyl124triazol4yl)1(5methylthiophen2yl)methanimine
3(difluoromethyl)5(methylsulfanyl)N((E)(5methylthiophen2yl)methylidene)4H124triazol4amine
828275247
CC1=CC=C(S1)C=NN2C(=NN=C2SC)C(F)F
CSc1nnc(n1N=Cc1ccc(s1)C)C(F)F
InChI=1SC10H10F2N4S2c16347(186)513169(8(11)12)141510(16)172h358H12H3b135+
MFCD05666896
ZINC000002788825
ZINC2788824

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Available files

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