Vitas-M small molecule compound
3-[2-(ethylsulfanyl)ethyl] 6-methyl 4-(3-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK407399
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)OCC)C(=O)C(C(C2)C)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 C26H33NO6S MW 487.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO6S/c1-6-32-18-10-8-9-17(14-18)22-21(26(30)33-11-12-34-7-2)16(4)27-19-13-15(3)20(25(29)31-5)24(28)23(19)22/h8-10,14-15,20,22,27H,6-7,11-13H2,1-5H3InChIKey
OUUXMPZGTPJTOU-UHFFFAOYSA-NSynonyms
3(2(ethylsulfanyl)ethyl)6methyl4(3ethoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethylsulfanylethyl)6Omethyl4(3ethoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC1=CC=CC(=C1)C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OCCSCC)C
InChI=1SC26H33NO6Sc163218108917(1418)2221(26(30)3311123472)16(4)27191315(3)20(25(29)315)24(28)23(19)22h8101415202227H671113H215H3
MFCD04057048
ZINC000009672770
ZINC000102008984
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