Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 7-(4-fluorophenyl)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406137
SMILES Cc1ccc(o1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)F)C(=O)OCC1CCCO1
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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 C27H28FNO5 MW 465.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FNO5/c1-15-5-10-23(34-15)26-24(27(31)33-14-20-4-3-11-32-20)16(2)29-21-12-18(13-22(30)25(21)26)17-6-8-19(28)9-7-17/h5-10,18,20,26,29H,3-4,11-14H2,1-2H3InChIKey
AHVNWLWYRUEBEM-UHFFFAOYSA-NSynonyms
CC1=CC=C(O1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)F)NC(=C2C(=O)OCC5CCCO5)C
InChI=1SC27H28FNO5c11551023(3415)2624(27(31)33142043113220)16(2)29211218(1322(30)25(21)26)176819(28)9717h51018202629H341114H212H3
MFCD05986929
oxolan2ylmethyl7(4fluorophenyl)2methyl4(5methylfuran2yl)5oxo4678tetrahydro1Hquinoline3carboxylate
tetrahydrofuran2ylmethyl7(4fluorophenyl)2methyl4(5methylfuran2yl)5oxo145678hexahydroquinoline3carboxylate
ZINC000100472073
ZINC000100472081
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