Vitas-M small molecule compound
2-ethoxyethyl 4-(3-hydroxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402749
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)O)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 C25H27NO5S MW 453.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO5S/c1-3-30-9-10-31-25(29)22-15(2)26-19-13-17(21-8-5-11-32-21)14-20(28)24(19)23(22)16-6-4-7-18(27)12-16/h4-8,11-12,17,23,26-27H,3,9-10,13-14H2,1-2H3InChIKey
KANXOLNMLRJQLT-UHFFFAOYSA-NSynonyms
2ethoxyethyl4(3hydroxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2ethoxyethyl4(3hydroxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)O)C(=O)CC(C2)C4=CC=CS4)C
InChI=1SC25H27NO5Sc13309103125(29)2215(2)26191317(2185113221)1420(28)24(19)23(22)1664718(27)1216h48111217232627H39101314H212H3
MFCD02868449
ZINC000002731743
ZINC000100127197
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