Vitas-M small molecule compound
2-methoxyethyl 4-[4-(methoxycarbonyl)phenyl]-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403049
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C(=O)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 C26H27NO6S MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO6S/c1-15-22(26(30)33-11-10-31-2)23(16-6-8-17(9-7-16)25(29)32-3)24-19(27-15)13-18(14-20(24)28)21-5-4-12-34-21/h4-9,12,18,23,27H,10-11,13-14H2,1-3H3InChIKey
MIWPICCFXYYMAA-UHFFFAOYSA-NSynonyms
2methoxyethyl4(4(methoxycarbonyl)phenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2methoxyethyl4(4methoxycarbonylphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC=C(C=C4)C(=O)OC)C(=O)OCCOC
InChI=1SC26H27NO6Sc11522(26(30)331110312)23(166817(9716)25(29)323)2419(2715)1318(1420(24)28)2154123421h4912182327H10111314H213H3
MFCD03371056
ZINC000003639589
ZINC000003639934
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