Vitas-M small molecule compound
methyl 2-amino-4-(4-bromophenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK673878
SMILES COC(=O)C1=C(N)N(c2cccc(c2)C(F)(F)F)C2=C(C1c1ccc(cc1)Br)C(=O)CCC2
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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 C24H20BrF3N2O3 MW 521.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrF3N2O3/c1-33-23(32)21-19(13-8-10-15(25)11-9-13)20-17(6-3-7-18(20)31)30(22(21)29)16-5-2-4-14(12-16)24(26,27)28/h2,4-5,8-12,19H,3,6-7,29H2,1H3InChIKey
PEXFPIUAAKIQJV-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)Br)C(=O)CCC2)C4=CC=CC(=C4)C(F)(F)F)N
InChI=1SC24H20BrF3N2O3c13323(32)2119(1381015(25)11913)2017(63718(20)31)30(22(21)29)1652414(1216)24(2627)28h24581219H36729H21H3
methyl2amino4(4bromophenyl)5oxo1(3(trifluoromethyl)phenyl)145678hexahydroquinoline3carboxylate
methyl2amino4(4bromophenyl)5oxo1(3(trifluoromethyl)phenyl)4678tetrahydroquinoline3carboxylate
MFCD01239776
ZINC000003664622
ZINC000003664623
Check stock
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Check stock on Vitas-MAvailable files
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