Vitas-M small molecule compound
cyclopentyl 2-methyl-5-oxo-7-phenyl-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363750
SMILES O=C(C1=C(C)NC2=C(C1c1ccccn1)C(=O)CC(C2)c1ccccc1)OC1CCCC1
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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 C27H28N2O3 MW 428.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3/c1-17-24(27(31)32-20-11-5-6-12-20)26(21-13-7-8-14-28-21)25-22(29-17)15-19(16-23(25)30)18-9-3-2-4-10-18/h2-4,7-10,13-14,19-20,26,29H,5-6,11-12,15-16H2,1H3InChIKey
WGYBLWANKDMAFX-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=N4)C(=O)OC5CCCC5
cyclopentyl2methyl5oxo7phenyl4(pyridin2yl)145678hexahydroquinoline3carboxylate
cyclopentyl2methyl5oxo7phenyl4pyridin2yl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H28N2O3c11724(27(31)322011561220)26(211378142821)2522(2917)1519(1623(25)30)1893241018h24710131419202629H5611121516H21H3
MFCD00771488
ZINC000019761402
ZINC000019761411
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