Vitas-M small molecule compound
2-[(3-fluorobenzyl)sulfanyl]-1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Catalog ID
STK448104
SMILES Fc1cccc(c1)CSCC(=O)N1N=C(CC1(O)C(F)(F)F)C
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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 C14H14F4N2O2S MW 350.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F4N2O2S/c1-9-6-13(22,14(16,17)18)20(19-9)12(21)8-23-7-10-3-2-4-11(15)5-10/h2-5,22H,6-8H2,1H3InChIKey
KIQIIJJPEZPKAY-UHFFFAOYSA-NSynonyms
2((3FLUOROBENZYL)SULFANYL)1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL1YL)ETHANONE
2((3fluorophenyl)methylsulfanyl)1(5hydroxy3methyl5(trifluoromethyl)4Hpyrazol1yl)ethanone
2((3FLUOROPHENYL)METHYLTHIO)1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)(2PYRAZOLINYL))ETHAN1ONE
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)CSCC2=CC(=CC=C2)F
InChI=1SC14H14F4N2O2Sc19613(2214(1617)18)20(199)12(21)82371032411(15)510h2522H68H21H3
MFCD04137636
ZINC000006263562
ZINC000006263578
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