Vitas-M small molecule compound
2-(ethylsulfanyl)ethyl 2,7,7-trimethyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK007298
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1OC)OC)OC)C(=O)CC(C2)(C)C
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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 C26H35NO6S MW 489.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35NO6S/c1-8-34-12-11-33-25(29)20-15(2)27-17-13-26(3,4)14-18(28)22(17)21(20)16-9-10-19(30-5)24(32-7)23(16)31-6/h9-10,21,27H,8,11-14H2,1-7H3InChIKey
ZJUMKUQALKMGDH-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)ethyl277trimethyl5oxo4(234trimethoxyphenyl)145678hexahydroquinoline3carboxylate
2ethylsulfanylethyl277trimethyl5oxo4(234trimethoxyphenyl)1468tetrahydroquinoline3carboxylate
CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1OC)OC)OC)C(=O)CC(C2)(C)C
CCSCCOC(=O)C1=C(NC2=C(C1C3=C(C(=C(C=C3)OC)OC)OC)C(=O)CC(C2)(C)C)C
InChI=1SC26H35NO6Sc183412113325(29)2015(2)27171326(34)1418(28)22(17)21(20)1691019(305)24(327)23(16)316h9102127H81114H217H3
MFCD02375990
STK007298
ZINC000002784319
ZINC000002784320
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