Vitas-M small molecule compound

propyl 7-(4-chlorophenyl)-4-(2-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK058549
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccc(cc1)Cl

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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 C26H25ClFNO3 MW 453.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClFNO3/c1-3-12-32-26(31)23-15(2)29-21-13-17(16-8-10-18(27)11-9-16)14-22(30)25(21)24(23)19-6-4-5-7-20(19)28/h4-11,17,24,29H,3,12-14H2,1-2H3
InChIKey
FHYMLBDWYCUYQH-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccc(cc1)Cl
CCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3F)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C
InChI=1SC26H25ClFNO3c13123226(31)2315(2)29211317(1681018(27)11916)1422(30)25(21)24(23)19645720(19)28h411172429H31214H212H3
MFCD01590154
propyl7(4chlorophenyl)4(2fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl7(4chlorophenyl)4(2fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK058549
ZINC000002758199
ZINC000002758202

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Available files

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