Vitas-M small molecule compound
2-phenylethyl 7-(4-chlorophenyl)-4-(2-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363631
SMILES Clc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccccc1F)C(=O)OCCc1ccccc1)C
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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 C31H27ClFNO3 MW 516.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClFNO3/c1-19-28(31(36)37-16-15-20-7-3-2-4-8-20)29(24-9-5-6-10-25(24)33)30-26(34-19)17-22(18-27(30)35)21-11-13-23(32)14-12-21/h2-14,22,29,34H,15-18H2,1H3InChIKey
RHGXARMWCLVIED-UHFFFAOYSA-NSynonyms
2phenylethyl7(4chlorophenyl)4(2fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl7(4chlorophenyl)4(2fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4F)C(=O)OCCC5=CC=CC=C5
InChI=1SC31H27ClFNO3c11928(31(36)371615207324820)29(249561025(24)33)3026(3419)1722(1827(30)35)21111323(32)141221h214222934H1518H21H3
MFCD01446363
ZINC000002061982
ZINC000002061985
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