Vitas-M small molecule compound
ethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(3-phenoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK052974
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Oc1ccccc1)C(=O)CC(C2)c1ccc(c(c1)OC)OC
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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 C33H33NO6 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO6/c1-5-39-33(36)30-20(2)34-26-17-23(21-14-15-28(37-3)29(19-21)38-4)18-27(35)32(26)31(30)22-10-9-13-25(16-22)40-24-11-7-6-8-12-24/h6-16,19,23,31,34H,5,17-18H2,1-4H3InChIKey
HRTQWKVYYXSVFO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Oc1ccccc1)C(=O)CC(C2)c1ccc(c(c1)OC)OC
CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)CC(C2)C5=CC(=C(C=C5)OC)OC)C
ethyl7(34dimethoxyphenyl)2methyl5oxo4(3phenoxyphenyl)145678hexahydroquinoline3carboxylate
ethyl7(34dimethoxyphenyl)2methyl5oxo4(3phenoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC33H33NO6c153933(36)3020(2)34261723(21141528(373)29(1921)384)1827(35)32(26)31(30)221091325(1622)4024117681224h61619233134H51718H214H3
MFCD02224193
STK052974
ZINC000000678888
ZINC000000678906
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