Vitas-M small molecule compound
4-methoxybenzyl 4-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402977
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)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 C31H31NO6S MW 545.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO6S/c1-18-28(31(34)38-17-19-7-10-22(35-2)11-8-19)29(20-9-12-25(36-3)26(16-20)37-4)30-23(32-18)14-21(15-24(30)33)27-6-5-13-39-27/h5-13,16,21,29,32H,14-15,17H2,1-4H3InChIKey
YUOPCKUXXVLCKX-UHFFFAOYSA-NSynonyms
(4methoxyphenyl)methyl4(34dimethoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
4methoxybenzyl4(34dimethoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC)C(=O)OCC5=CC=C(C=C5)OC
InChI=1SC31H31NO6Sc11828(31(34)38171971022(352)11819)29(2091225(363)26(1620)374)3023(3218)1421(1524(30)33)2765133927h51316212932H141517H214H3
MFCD03371003
ZINC000001438576
ZINC000001438579
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