Vitas-M small molecule compound
4-(3-methylphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307052
SMILES Cc1cccc(c1)n1c(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 C17H13F4N3OS MW 383.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F4N3OS/c1-10-4-2-6-12(8-10)24-14(22-23-16(24)26)11-5-3-7-13(9-11)25-17(20,21)15(18)19/h2-9,15H,1H3,(H,23,26)InChIKey
ULNFWNNCEZMLKR-UHFFFAOYSA-NSynonyms
828287-55-44(3methylphenyl)3(3(1122tetrafluoroethoxy)phenyl)1H124triazole5thione
4(3methylphenyl)5(3(1122tetrafluoroethoxy)phenyl)4H124triazole3thiol
828287554
CC1=CC(=CC=C1)N2C(=NNC2=S)C3=CC(=CC=C3)OC(C(F)F)(F)F
InChI=1SC17H13F4N3OSc11042612(810)2414(222316(24)26)1153713(911)2517(2021)15(18)19h2915H1H3(H2326)
MFCD04047943
ZINC000006628173
ZINC6628173
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