Vitas-M small molecule compound
benzyl 2-methyl-4-(5-methylfuran-2-yl)-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403002
SMILES Cc1ccc(o1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCc1ccccc1
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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 C27H25NO4S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO4S/c1-16-10-11-22(32-16)26-24(27(30)31-15-18-7-4-3-5-8-18)17(2)28-20-13-19(14-21(29)25(20)26)23-9-6-12-33-23/h3-12,19,26,28H,13-15H2,1-2H3InChIKey
WQOGOCSPRKPQCH-UHFFFAOYSA-NSynonyms
benzyl2methyl4(5methylfuran2yl)5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
benzyl2methyl4(5methylfuran2yl)5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=CC=C(O1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC(=C2C(=O)OCC5=CC=CC=C5)C
InChI=1SC27H25NO4Sc116101122(3216)2624(27(30)3115187435818)17(2)28201319(1421(29)25(20)26)2396123323h312192628H1315H212H3
MFCD03145223
ZINC000008934923
ZINC000008934926
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