Vitas-M small molecule compound

4-(3-bromo-4-hydroxy-5-methoxyphenyl)-N-(4-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide

Catalog ID
STK406174
SMILES COc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ccc(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 C24H22BrFN2O4 MW 501.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrFN2O4/c1-12-20(24(31)28-15-8-6-14(26)7-9-15)21(22-17(27-12)4-3-5-18(22)29)13-10-16(25)23(30)19(11-13)32-2/h6-11,21,27,30H,3-5H2,1-2H3,(H,28,31)
InChIKey
DNNMMDCXYVRCBO-UHFFFAOYSA-N
Synonyms

4(3bromo4hydroxy5methoxyphenyl)N(4fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxamide
4(3bromo4hydroxy5methoxyphenyl)N(4fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxamide
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)Br)O)OC)C(=O)NC4=CC=C(C=C4)F
InChI=1SC24H22BrFN2O4c11220(24(31)28158614(26)7915)21(2217(2712)43518(22)29)131016(25)23(30)19(1113)322h611212730H35H212H3(H2831)
MFCD05986882
ZINC000001129861
ZINC000016294055

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Available files

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