Vitas-M small molecule compound
ethyl 1-(4-fluorophenyl)-4-(4-methoxyphenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Catalog ID
STK686067
SMILES CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2c1ccc(cc1)F)c1ccc(cc1)OC)c1cccs1
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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 C29H26FNO5S MW 519.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26FNO5S/c1-3-36-29(34)27-22(24-5-4-14-37-24)15-23-26(28(27)33)21(17-6-12-20(35-2)13-7-17)16-25(32)31(23)19-10-8-18(30)9-11-19/h4-14,21-22,27H,3,15-16H2,1-2H3InChIKey
IQNWHCQMGNISTN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2C3=CC=C(C=C3)F)C4=CC=C(C=C4)OC)C5=CC=CS5ethyl1(4fluorophenyl)4(4methoxyphenyl)25dioxo7(thiophen2yl)12345678octahydroquinoline6carboxylate
ethyl1(4fluorophenyl)4(4methoxyphenyl)25dioxo7thiophen2yl4678tetrahydro3Hquinoline6carboxylate
Registry IDs
MFCD06014432ZINC000012413027
ZINC000014944035
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.