Vitas-M small molecule compound
4-(2-bromo-3-hydroxy-4-methoxyphenyl)-6-methyl-2-oxo-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL181486
SMILES COc1ccc(c(c1O)Br)C1NC(=O)NC(=C1C(=O)Nc1cccc(c1)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 C20H17BrF3N3O4 MW 500.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrF3N3O4/c1-9-14(18(29)26-11-5-3-4-10(8-11)20(22,23)24)16(27-19(30)25-9)12-6-7-13(31-2)17(28)15(12)21/h3-8,16,28H,1-2H3,(H,26,29)(H2,25,27,30)InChIKey
MUALDPCZFXEAEJ-UHFFFAOYSA-NSynonyms
4(2bromo3hydroxy4methoxyphenyl)6methyl2oxoN(3(trifluoromethyl)phenyl)1234tetrahydropyrimidine5carboxamide
4(2bromo3hydroxy4methoxyphenyl)6methyl2oxoN(3(trifluoromethyl)phenyl)34dihydro1Hpyrimidine5carboxamide
CC1=C(C(NC(=O)N1)C2=C(C(=C(C=C2)OC)O)Br)C(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC20H17BrF3N3O4c1914(18(29)261153410(811)20(2223)24)16(2719(30)259)126713(312)17(28)15(12)21h381628H12H3(H2629)(H2252730)
MFCD06195828
ZINC000016606807
ZINC000016606811
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