Vitas-M small molecule compound

tetrahydrofuran-2-ylmethyl 2-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK087166
SMILES O=C(C1=C(C)NC2=C(C1c1cccc(c1)C(F)(F)F)C(=O)CCC2)OCC1CCCO1

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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 C23H24F3NO4 MW 435.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24F3NO4/c1-13-19(22(29)31-12-16-7-4-10-30-16)20(21-17(27-13)8-3-9-18(21)28)14-5-2-6-15(11-14)23(24,25)26/h2,5-6,11,16,20,27H,3-4,7-10,12H2,1H3
InChIKey
YZBNWSFABFKJIG-UHFFFAOYSA-N
Synonyms
312698-34-3
312698343
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)C(F)(F)F)C(=O)OCC4CCCO4
InChI=1SC23H24F3NO4c11319(22(29)31121674103016)20(2117(2713)83918(21)28)1452615(1114)23(2425)26h25611162027H3471012H21H3
MFCD01975534
O=C(C1=C(C)NC2=C(C1c1cccc(c1)C(F)(F)F)C(=O)CCC2)OCC1CCCO1
oxolan2ylmethyl2methyl5oxo4(3(trifluoromethyl)phenyl)4678tetrahydro1Hquinoline3carboxylate
STK087166
tetrahydrofuran2ylmethyl2methyl5oxo4(3(trifluoromethyl)phenyl)145678hexahydroquinoline3carboxylate
ZINC000000675135
ZINC000000675148

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Available files

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