Vitas-M small molecule compound
5-ethyl-4-({(E)-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173272
SMILES CCc1nnc(n1/N=C/c1cccc(c1)OC(C(F)F)(F)F)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 C13H12F4N4OS MW 348.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12F4N4OS/c1-2-10-19-20-12(23)21(10)18-7-8-4-3-5-9(6-8)22-13(16,17)11(14)15/h3-7,11H,2H2,1H3,(H,20,23)/b18-7+InChIKey
OZRWVSRNXJFNBG-CNHKJKLMSA-NSynonyms
866742-99-63ethyl4((E)(3(1122tetrafluoroethoxy)phenyl)methylideneamino)1H124triazole5thione
5ethyl4(((E)(3(1122tetrafluoroethoxy)phenyl)methylidene)amino)4H124triazole3thiol
866742996
CCC1=NNC(=S)N1N=CC2=CC(=CC=C2)OC(C(F)F)(F)F
CCc1nnc(n1N=Cc1cccc(c1)OC(C(F)F)(F)F)S
InChI=1SC13H12F4N4OSc1210192012(23)21(10)18784359(68)2213(1617)11(14)15h3711H2H21H3(H2023)b187+
MFCD06196113
ZINC000036611503
ZINC96569310
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