Vitas-M small molecule compound
3-(butylsulfanyl)-5-(difluoromethyl)-N-[(E)-{5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-2-yl}methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STL173330
SMILES CCCCSc1nnc(n1/N=C/c1ccc(o1)COc1c(F)c(F)cc(c1F)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 C19H16F6N4O2S MW 478.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F6N4O2S/c1-2-3-6-32-19-28-27-18(17(24)25)29(19)26-8-10-4-5-11(31-10)9-30-16-14(22)12(20)7-13(21)15(16)23/h4-5,7-8,17H,2-3,6,9H2,1H3/b26-8+InChIKey
HEHMLTZIICVBIT-MWRNPHMMSA-NSynonyms
866816-81-1(E)N(3butylsulfanyl5(difluoromethyl)124triazol4yl)1(5((2356tetrafluorophenoxy)methyl)furan2yl)methanimine
3(butylsulfanyl)5(difluoromethyl)N((E)(5((2356tetrafluorophenoxy)methyl)furan2yl)methylidene)4H124triazol4amine
866816811
CCCCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C(=CC(=C3F)F)F)F)C(F)F
CCCCSc1nnc(n1N=Cc1ccc(o1)COc1c(F)c(F)cc(c1F)F)C(F)F
InChI=1SC19H16F6N4O2Sc12363219282718(17(24)25)29(19)268104511(3110)9301614(22)12(20)713(21)15(16)23h457817H2369H21H3b268+
MFCD06197178
ZINC000036611883
ZINC96577125
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