Vitas-M small molecule compound
4-(furan-2-ylmethyl)-5-{1-[3-(trifluoromethyl)phenoxy]ethyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448452
SMILES CC(c1nnc(n1Cc1ccco1)S)Oc1cccc(c1)C(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 C16H14F3N3O2S MW 369.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3N3O2S/c1-10(24-12-5-2-4-11(8-12)16(17,18)19)14-20-21-15(25)22(14)9-13-6-3-7-23-13/h2-8,10H,9H2,1H3,(H,21,25)InChIKey
ZYZQSFDFDDBPBH-UHFFFAOYSA-NSynonyms
4(2FURYLMETHYL)5((3(TRIFLUOROMETHYL)PHENOXY)ETHYL)124TRIAZOLE3THIOL
4(furan2ylmethyl)3(1(3(trifluoromethyl)phenoxy)ethyl)1H124triazole5thione
4(furan2ylmethyl)5(1(3(trifluoromethyl)phenoxy)ethyl)4H124triazole3thiol
CC(C1=NNC(=S)N1CC2=CC=CO2)OC3=CC=CC(=C3)C(F)(F)F
InChI=1SC16H14F3N3O2Sc110(241252411(812)16(1718)19)14202115(25)22(14)9136372313h2810H9H21H3(H2125)
MFCD04141003
ZINC000017075696
ZINC000017075697
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