Vitas-M small molecule compound

1-phenyl-2-({5-[(quinolin-8-yloxy)methyl]-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone

Catalog ID
STK807684
SMILES O=C(c1ccccc1)CSc1nnc(n1c1cccc(c1)C(F)(F)F)COc1cccc2c1nccc2

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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 C27H19F3N4O2S MW 520.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19F3N4O2S/c28-27(29,30)20-11-5-12-21(15-20)34-24(16-36-23-13-4-9-19-10-6-14-31-25(19)23)32-33-26(34)37-17-22(35)18-7-2-1-3-8-18/h1-15H,16-17H2
InChIKey
DLTMNTSATOVXSQ-UHFFFAOYSA-N
Synonyms

1phenyl2((5((quinolin8yloxy)methyl)4(3(trifluoromethyl)phenyl)4H124triazol3yl)sulfanyl)ethanone
1PHENYL2((5(QUINOLIN8YLOXYMETHYL)4(3(TRIFLUOROMETHYL)PHENYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1PHENYL2(5(8QUINOLYLOXYMETHYL)4(3(TRIFLUOROMETHYL)PHENYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)COC4=CC=CC5=C4N=CC=C5
InChI=1SC27H19F3N4O2Sc2827(2930)201151221(1520)3424(163623134919106143125(19)23)323326(34)371722(35)187213818h115H1617H2
MFCD05719043
ZINC000002586489
ZINC2586489

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Available files

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