Vitas-M small molecule compound
3-(difluoromethyl)-5-(methylsulfanyl)-N-{(E)-[5-(phenoxymethyl)furan-2-yl]methylidene}-4H-1,2,4-triazol-4-amine
Catalog ID
STL178737
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1ccccc1)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 C16H14F2N4O2S MW 364.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F2N4O2S/c1-25-16-21-20-15(14(17)18)22(16)19-9-12-7-8-13(24-12)10-23-11-5-3-2-4-6-11/h2-9,14H,10H2,1H3/b19-9+InChIKey
MQAFXTRRFSEDOW-DJKKODMXSA-NSynonyms
866563-94-2(E)N(3(difluoromethyl)5methylsulfanyl124triazol4yl)1(5(phenoxymethyl)furan2yl)methanimine
3(difluoromethyl)5(methylsulfanyl)N((E)(5(phenoxymethyl)furan2yl)methylidene)4H124triazol4amine
866563942
CSC1=NN=C(N1N=CC2=CC=C(O2)COC3=CC=CC=C3)C(F)F
CSc1nnc(n1N=Cc1ccc(o1)COc1ccccc1)C(F)F
InChI=1SC16H14F2N4O2Sc12516212015(14(17)18)22(16)199127813(2412)1023115324611h2914H10H21H3b199+
MFCD08553316
ZINC000036611322
ZINC96569414
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