Vitas-M small molecule compound
[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone
Catalog ID
STK430471
SMILES CC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1csc2c1CCCC2
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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 C14H15F3N2O2S MW 332.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15F3N2O2S/c1-8-6-13(21,14(15,16)17)19(18-8)12(20)10-7-22-11-5-3-2-4-9(10)11/h7,21H,2-6H2,1H3InChIKey
LLLWFSSDEUAHIP-UHFFFAOYSA-NSynonyms
(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)(4567tetrahydro1benzothiophen3yl)methanone
(5hydroxy3methyl5(trifluoromethyl)4Hpyrazol1yl)(4567tetrahydro1benzothiophen3yl)methanone
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CSC3=C2CCCC3
InChI=1SC14H15F3N2O2Sc18613(2114(1516)17)19(188)12(20)107221153249(10)11h721H26H21H3
MFCD03465536
ZINC000004124136
ZINC000004124137
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