Vitas-M small molecule compound
2-ethoxyethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK098211
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)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 C26H29NO5S MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO5S/c1-4-31-11-12-32-26(29)23-16(2)27-20-14-18(22-6-5-13-33-22)15-21(28)25(20)24(23)17-7-9-19(30-3)10-8-17/h5-10,13,18,24,27H,4,11-12,14-15H2,1-3H3InChIKey
BGVJWEOLVHNTKM-UHFFFAOYSA-NSynonyms
2ethoxyethyl4(4methoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2ethoxyethyl4(4methoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC)C(=O)CC(C2)c1cccs1
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)OC)C(=O)CC(C2)C4=CC=CS4)C
InChI=1SC26H29NO5Sc143111123226(29)2316(2)27201418(2265133322)1521(28)25(20)24(23)177919(303)10817h51013182427H411121415H213H3
MFCD02627384
STK098211
ZINC000002867983
ZINC000019867159
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