Vitas-M small molecule compound
4-ethyl-5-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306817
SMILES CCn1c(S)nnc1c1cccc(c1)COCC(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 C14H15F4N3OS MW 349.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15F4N3OS/c1-2-21-11(19-20-13(21)23)10-5-3-4-9(6-10)7-22-8-14(17,18)12(15)16/h3-6,12H,2,7-8H2,1H3,(H,20,23)InChIKey
DAQKBVYNUTUNDT-UHFFFAOYSA-NSynonyms
828285-15-04ethyl3(3(2233tetrafluoropropoxymethyl)phenyl)1H124triazole5thione
4ethyl5(3((2233tetrafluoropropoxy)methyl)phenyl)4H124triazole3thiol
828285150
CCN1C(=NNC1=S)C2=CC(=CC=C2)COCC(C(F)F)(F)F
InChI=1SC14H15F4N3OSc122111(192013(21)23)105349(610)722814(1718)12(15)16h3612H278H21H3(H2023)
MFCD03423542
ZINC000002573483
ZINC02573483
ZINC2573483
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