Vitas-M small molecule compound
2-methoxyethyl 4-(5-bromo-2-fluorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403130
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1cc(Br)ccc1F)C(=O)CC(C2)c1cccs1
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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 C24H23BrFNO4S MW 520.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23BrFNO4S/c1-13-21(24(29)31-8-7-30-2)22(16-12-15(25)5-6-17(16)26)23-18(27-13)10-14(11-19(23)28)20-4-3-9-32-20/h3-6,9,12,14,22,27H,7-8,10-11H2,1-2H3InChIKey
CTDMWNOQPYRITM-UHFFFAOYSA-NSynonyms
2methoxyethyl4(5bromo2fluorophenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2methoxyethyl4(5bromo2fluorophenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=C(C=CC(=C4)Br)F)C(=O)OCCOC
InChI=1SC24H23BrFNO4Sc11321(24(29)3187302)22(161215(25)5617(16)26)2318(2713)1014(1119(23)28)204393220h36912142227H781011H212H3
MFCD03371100
ZINC000003639957
ZINC000003639967
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