Vitas-M small molecule compound
4-{[(E)-{3-[(biphenyl-4-yloxy)methyl]-4-methoxyphenyl}methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173769
SMILES COc1ccc(cc1COc1ccc(cc1)c1ccccc1)/C=N/n1c(S)nnc1C(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 C24H19F3N4O2S MW 484.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19F3N4O2S/c1-32-21-12-7-16(14-28-31-22(24(25,26)27)29-30-23(31)34)13-19(21)15-33-20-10-8-18(9-11-20)17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,30,34)/b28-14+InChIKey
BKJSIGHBROZSMP-CCVNUDIWSA-NSynonyms
828284-42-04(((E)(3((biphenyl4yloxy)methyl)4methoxyphenyl)methylidene)amino)5(trifluoromethyl)4H124triazole3thiol
4((E)(4methoxy3((4phenylphenoxy)methyl)phenyl)methylideneamino)3(trifluoromethyl)1H124triazole5thione
828284420
COC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C(F)(F)F)COC3=CC=C(C=C3)C4=CC=CC=C4
COc1ccc(cc1COc1ccc(cc1)c1ccccc1)C=Nn1c(S)nnc1C(F)(F)F
InChI=1SC24H19F3N4O2Sc1322112716(14283122(24(2526)27)293023(31)34)1319(21)15332010818(91120)175324617h214H15H21H3(H3034)b2814+
MFCD04047805
ZINC000002791778
ZINC2791777
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