Vitas-M small molecule compound
5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173896
SMILES CCOc1cc(ccc1OC(F)F)c1nnc(n1CC)S
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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 C13H15F2N3O2S MW 315.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15F2N3O2S/c1-3-18-11(16-17-13(18)21)8-5-6-9(20-12(14)15)10(7-8)19-4-2/h5-7,12H,3-4H2,1-2H3,(H,17,21)InChIKey
OQBFKZCMLVFVPC-UHFFFAOYSA-NSynonyms
828291-12-93(4(DIFLUOROMETHOXY)3ETHOXYPHENYL)4ETHYL1H124TRIAZOLE5THIONE
5(4(difluoromethoxy)3ethoxyphenyl)4ethyl4H124triazole3thiol
828291129
CCN1C(=NNC1=S)C2=CC(=C(C=C2)OC(F)F)OCC
InChI=1SC13H15F2N3O2Sc131811(161713(18)21)8569(2012(14)15)10(78)1942h5712H34H212H3(H1721)
MFCD04056663
ZINC000008484678
ZINC08484678
ZINC8484678
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