Vitas-M small molecule compound
ethyl 7-(furan-2-yl)-2-methyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406142
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccs1)C(=O)CC(C2)c1ccco1
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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 C21H21NO4S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4S/c1-3-25-21(24)18-12(2)22-14-10-13(16-6-4-8-26-16)11-15(23)19(14)20(18)17-7-5-9-27-17/h4-9,13,20,22H,3,10-11H2,1-2H3InChIKey
OTAYBVMRRAFUDU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=O)CC(C2)C4=CC=CO4)C
ethyl7(furan2yl)2methyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
ethyl7(furan2yl)2methyl5oxo4thiophen2yl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC21H21NO4Sc132521(24)1812(2)22141013(166482616)1115(23)19(14)20(18)177592717h49132022H31011H212H3
MFCD05986691
ZINC000002844407
ZINC000002844410
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