Vitas-M small molecule compound
butyl 2,7,7-trimethyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK089581
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccccn1)C(=O)CC(C2)(C)C
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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 C22H28N2O3 MW 368.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O3/c1-5-6-11-27-21(26)18-14(2)24-16-12-22(3,4)13-17(25)19(16)20(18)15-9-7-8-10-23-15/h7-10,20,24H,5-6,11-13H2,1-4H3InChIKey
HOLYIDAAZZBEMD-UHFFFAOYSA-NSynonyms
butyl277trimethyl5oxo4(pyridin2yl)145678hexahydroquinoline3carboxylate
butyl277trimethyl5oxo4pyridin2yl1468tetrahydroquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1ccccn1)C(=O)CC(C2)(C)C
CCCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=N3)C(=O)CC(C2)(C)C)C
InChI=1SC22H28N2O3c156112721(26)1814(2)24161222(34)1317(25)19(16)20(18)15978102315h7102024H561113H214H3
MFCD00753287
STK089581
ZINC000019536415
ZINC000019536417
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