Vitas-M small molecule compound
1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-{[4-(4-methoxyphenyl)pyrimidin-2-yl]sulfanyl}ethanone
Catalog ID
STK305943
SMILES COc1ccc(cc1)c1ccnc(n1)SCC(=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 C18H17F3N4O3S MW 426.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3N4O3S/c1-11-9-17(27,18(19,20)21)25(24-11)15(26)10-29-16-22-8-7-14(23-16)12-3-5-13(28-2)6-4-12/h3-8,27H,9-10H2,1-2H3InChIKey
OLRANQCEZDIROC-UHFFFAOYSA-NSynonyms
680207-86-71(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)2((4(4methoxyphenyl)pyrimidin2yl)sulfanyl)ethanone
1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)2(4(4METHOXYPHENYL)PYRIMIDIN2YL)SULFANYLETHANONE
680207867
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)CSC2=NC=CC(=N2)C3=CC=C(C=C3)OC
InChI=1SC18H17F3N4O3Sc111917(2718(1920)21)25(2411)15(26)102916228714(2316)123513(282)6412h3827H910H212H3
MFCD04046201
ZINC000013642552
ZINC000013642555
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