Vitas-M small molecule compound
2-ethoxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK078455
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)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 C26H29NO6S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6S/c1-4-32-9-10-33-26(30)23-15(2)27-18-12-17(22-6-5-11-34-22)14-20(29)25(18)24(23)16-7-8-21(31-3)19(28)13-16/h5-8,11,13,17,24,27-28H,4,9-10,12,14H2,1-3H3InChIKey
UDCHFJMGKIWKGD-UHFFFAOYSA-NSynonyms
2ethoxyethyl4(3hydroxy4methoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2ethoxyethyl4(3hydroxy4methoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)O)OC)C(=O)CC(C2)c1cccs1
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)O)C(=O)CC(C2)C4=CC=CS4)C
InChI=1SC26H29NO6Sc14329103326(30)2315(2)27181217(2265113422)1420(29)25(18)24(23)167821(313)19(28)1316h58111317242728H49101214H213H3
MFCD02627311
STK078455
ZINC000003639434
ZINC000100616561
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