Vitas-M small molecule compound
4-(2-methoxyphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306693
SMILES COc1ccccc1n1c(S)nnc1c1cccc(c1)OC(C(F)F)(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 C17H13F4N3O2S MW 399.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F4N3O2S/c1-25-13-8-3-2-7-12(13)24-14(22-23-16(24)27)10-5-4-6-11(9-10)26-17(20,21)15(18)19/h2-9,15H,1H3,(H,23,27)InChIKey
SZOKJFVNSDMODD-UHFFFAOYSA-NSynonyms
828282-47-94(2methoxyphenyl)3(3(1122tetrafluoroethoxy)phenyl)1H124triazole5thione
4(2methoxyphenyl)5(3(1122tetrafluoroethoxy)phenyl)4H124triazole3thiol
828282479
COC1=CC=CC=C1N2C(=NNC2=S)C3=CC(=CC=C3)OC(C(F)F)(F)F
InChI=1SC17H13F4N3O2Sc12513832712(13)2414(222316(24)27)1054611(910)2617(2021)15(18)19h2915H1H3(H2327)
MFCD04047932
ZINC000006911440
ZINC6911440
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