Vitas-M small molecule compound
benzyl 7-(4-fluorophenyl)-2-methyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406097
SMILES Fc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1cccs1)C(=O)OCc1ccccc1)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 C28H24FNO3S MW 473.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FNO3S/c1-17-25(28(32)33-16-18-6-3-2-4-7-18)27(24-8-5-13-34-24)26-22(30-17)14-20(15-23(26)31)19-9-11-21(29)12-10-19/h2-13,20,27,30H,14-16H2,1H3InChIKey
ZIXWZEJLTGVUDZ-UHFFFAOYSA-NSynonyms
benzyl7(4fluorophenyl)2methyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
benzyl7(4fluorophenyl)2methyl5oxo4thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)F)C4=CC=CS4)C(=O)OCC5=CC=CC=C5
InChI=1SC28H24FNO3Sc11725(28(32)3316186324718)27(2485133424)2622(3017)1420(1523(26)31)1991121(29)121019h213202730H1416H21H3
MFCD04216156
ZINC000002845075
ZINC000002845078
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