Vitas-M small molecule compound
dimethyl 4-(3-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK776003
SMILES COc1cccc(c1)C1C(=C(C)NC2=C1C(=O)C(C(C2)c1cccs1)C(=O)OC)C(=O)OC
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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 C25H25NO6S MW 467.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO6S/c1-13-19(24(28)31-3)20(14-7-5-8-15(11-14)30-2)22-17(26-13)12-16(18-9-6-10-33-18)21(23(22)27)25(29)32-4/h5-11,16,20-21,26H,12H2,1-4H3InChIKey
UHACTSFCGPUNLY-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OC)C3=CC=CS3)C4=CC(=CC=C4)OC)C(=O)OC
dimethyl4(3methoxyphenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline36dicarboxylate
dimethyl4(3methoxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline36dicarboxylate
InChI=1SC25H25NO6Sc11319(24(28)313)20(1475815(1114)302)2217(2613)1216(1896103318)21(23(22)27)25(29)324h51116202126H12H214H3
MFCD05258347
ZINC000019857836
ZINC000217601157
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