Vitas-M small molecule compound
4-hydroxy-5-[(4-methylphenyl)carbonyl]-6-[4-(propan-2-yl)phenyl]-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Catalog ID
STK823632
SMILES O=C1NC(c2ccc(cc2)C(C)C)C(C(N1)(O)C(F)(F)F)C(=O)c1ccc(cc1)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 C22H23F3N2O3 MW 420.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23F3N2O3/c1-12(2)14-8-10-15(11-9-14)18-17(19(28)16-6-4-13(3)5-7-16)21(30,22(23,24)25)27-20(29)26-18/h4-12,17-18,30H,1-3H3,(H2,26,27,29)InChIKey
KVKVUGPPNZNELY-UHFFFAOYSA-NSynonyms
4hydroxy5((4methylphenyl)carbonyl)6(4(propan2yl)phenyl)4(trifluoromethyl)tetrahydropyrimidin2(1H)one
4hydroxy5(4methylbenzoyl)6(4propan2ylphenyl)4(trifluoromethyl)13diazinan2one
CC1=CC=C(C=C1)C(=O)C2C(NC(=O)NC2(C(F)(F)F)O)C3=CC=C(C=C3)C(C)C
InChI=1SC22H23F3N2O3c112(2)1481015(11914)1817(19(28)166413(3)5716)21(3022(2324)25)2720(29)2618h412171830H13H3(H2262729)
MFCD03464131
ZINC000027020452
ZINC000027020470
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