Vitas-M small molecule compound
2-{[4-hydroxy-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylphenyl)ethanone
Catalog ID
STL406989
SMILES Oc1nc(SCC(=O)c2ccc(cc2)C)nc(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 C14H11F3N2O2S MW 328.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11F3N2O2S/c1-8-2-4-9(5-3-8)10(20)7-22-13-18-11(14(15,16)17)6-12(21)19-13/h2-6H,7H2,1H3,(H,18,19,21)InChIKey
CPGPSAVKHRKLCV-UHFFFAOYSA-NSynonyms
1798679-77-21798679772
2((4hydroxy6(trifluoromethyl)pyrimidin2yl)sulfanyl)1(4methylphenyl)ethanone
2(2(4methylphenyl)2oxoethyl)sulfanyl6(trifluoromethyl)1Hpyrimidin4one
CC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)C(F)(F)F
InChI=1SC14H11F3N2O2Sc18249(538)10(20)722131811(14(1516)17)612(21)1913h26H7H21H3(H181921)
MFCD30704617
ZINC000096306367
ZINC96306367
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