Vitas-M small molecule compound
3-[(4-nitrobenzyl)sulfanyl]-4-phenyl-5-[3-(trifluoromethyl)benzyl]-4H-1,2,4-triazole
Catalog ID
STK271525
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)Cc1cccc(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 C23H17F3N4O2S MW 470.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17F3N4O2S/c24-23(25,26)18-6-4-5-17(13-18)14-21-27-28-22(29(21)19-7-2-1-3-8-19)33-15-16-9-11-20(12-10-16)30(31)32/h1-13H,14-15H2InChIKey
AEQLYKHQGVWFIO-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)Cc1cccc(c1)C(F)(F)F
3((4nitrobenzyl)sulfanyl)4phenyl5(3(trifluoromethyl)benzyl)4H124triazole
3((4nitrophenyl)methylsulfanyl)4phenyl5((3(trifluoromethyl)phenyl)methyl)124triazole
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))CC4=CC(=CC=C4)C(F)(F)F
InChI=1SC23H17F3N4O2Sc2423(2526)1864517(1318)1421272822(29(21)197213819)33151691120(121016)30(31)32h113H1415H2
MFCD06191706
ZINC000009614264
ZINC09614264
ZINC9614264
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