Vitas-M small molecule compound

methyl 1-(4-fluorophenyl)-4-[(4-fluorophenyl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate

Catalog ID
STK790237
SMILES COC(=O)C1=C(C)N(C(=O)CC1C(=O)Nc1ccc(cc1)F)c1ccc(cc1)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 C21H18F2N2O4 MW 400.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F2N2O4/c1-12-19(21(28)29-2)17(20(27)24-15-7-3-13(22)4-8-15)11-18(26)25(12)16-9-5-14(23)6-10-16/h3-10,17H,11H2,1-2H3,(H,24,27)
InChIKey
FGIXFPYIJVWSCN-UHFFFAOYSA-N
Synonyms
1015568-22-5
1015568225
CC1=C(C(CC(=O)N1C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)F)C(=O)OC
InChI=1SC21H18F2N2O4c11219(21(28)292)17(20(27)24157313(22)4815)1118(26)25(12)169514(23)61016h31017H11H212H3(H2427)
methyl1(4fluorophenyl)4((4fluorophenyl)carbamoyl)2methyl6oxo1456tetrahydropyridine3carboxylate
methyl1(4fluorophenyl)4((4fluorophenyl)carbamoyl)6methyl2oxo34dihydropyridine5carboxylate
MFCD10479805
ZINC000019819130
ZINC000019819132

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.