Vitas-M small molecule compound
benzyl 4-[4-(diethylamino)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372446
SMILES CCN(c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1)CC
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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 C28H32N2O3 MW 444.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O3/c1-4-30(5-2)22-16-14-21(15-17-22)26-25(28(32)33-18-20-10-7-6-8-11-20)19(3)29-23-12-9-13-24(31)27(23)26/h6-8,10-11,14-17,26,29H,4-5,9,12-13,18H2,1-3H3InChIKey
SKKUHPMYBVGVIM-UHFFFAOYSA-NSynonyms
benzyl4(4(diethylamino)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(4(diethylamino)phenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCN(CC)C1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC4=CC=CC=C4)C
InChI=1SC28H32N2O3c1430(52)22161421(151722)2625(28(32)331820107681120)19(3)29231291324(31)27(23)26h68101114172629H459121318H213H3
MFCD00771235
ZINC000000714603
ZINC000000714604
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