Vitas-M small molecule compound

3-(4-methoxybenzyl) 6-methyl 2,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK404467
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1cccs1)C(=C(N2)C)C(=O)OCc1ccc(cc1)OC

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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 C26H27NO6S MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO6S/c1-14-12-18-22(24(28)20(14)25(29)32-4)23(19-6-5-11-34-19)21(15(2)27-18)26(30)33-13-16-7-9-17(31-3)10-8-16/h5-11,14,20,23,27H,12-13H2,1-4H3
InChIKey
SYBRBABYWVSVAT-UHFFFAOYSA-N
Synonyms

3(4methoxybenzyl)6methyl27dimethyl5oxo4(thiophen2yl)145678hexahydroquinoline36dicarboxylate
3O((4methoxyphenyl)methyl)6Omethyl27dimethyl5oxo4thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCC3=CC=C(C=C3)OC)C4=CC=CS4)C(=O)C1C(=O)OC
InChI=1SC26H27NO6Sc114121822(24(28)20(14)25(29)324)23(1965113419)21(15(2)2718)26(30)3313167917(313)10816h51114202327H1213H214H3
MFCD04220568
ZINC000020363875
ZINC000239212560

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Available files

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