Vitas-M small molecule compound
2-methoxyethyl 4-(4-bromophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK030090
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Br)C(=O)CC(C2)c1ccccc1
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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 C26H26BrNO4 MW 496.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrNO4/c1-16-23(26(30)32-13-12-31-2)24(18-8-10-20(27)11-9-18)25-21(28-16)14-19(15-22(25)29)17-6-4-3-5-7-17/h3-11,19,24,28H,12-15H2,1-2H3InChIKey
IQDBOZQEKZMKMQ-UHFFFAOYSA-NSynonyms
2methoxyethyl4(4bromophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2methoxyethyl4(4bromophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Br)C(=O)CC(C2)c1ccccc1
InChI=1SC26H26BrNO4c11623(26(30)321312312)24(1881020(27)11918)2521(2816)1419(1522(25)29)176435717h311192428H1215H212H3
MFCD00771434
STK030090
ZINC000002925638
ZINC000002925645
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