Vitas-M small molecule compound
methyl 7-(4-chlorophenyl)-4-(4-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK022438
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)F)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 C24H21ClFNO3 MW 425.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClFNO3/c1-13-21(24(29)30-2)22(15-5-9-18(26)10-6-15)23-19(27-13)11-16(12-20(23)28)14-3-7-17(25)8-4-14/h3-10,16,22,27H,11-12H2,1-2H3InChIKey
OFFYFBDLLLMXKK-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)F)C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC24H21ClFNO3c11321(24(29)302)22(155918(26)10615)2319(2713)1116(1220(23)28)143717(25)8414h310162227H1112H212H3
methyl7(4chlorophenyl)4(4fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl7(4chlorophenyl)4(4fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02766757
STK022438
ZINC000001204581
ZINC000001204593
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