Vitas-M small molecule compound

3-[2-(ethylsulfanyl)ethyl] 6-methyl 4-[4-(dimethylamino)phenyl]-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK407449
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)N(C)C)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 C26H34N2O5S MW 486.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O5S/c1-7-34-13-12-33-26(31)21-16(3)27-19-14-15(2)20(25(30)32-6)24(29)23(19)22(21)17-8-10-18(11-9-17)28(4)5/h8-11,15,20,22,27H,7,12-14H2,1-6H3
InChIKey
UYSUSEWPZPDVEL-UHFFFAOYSA-N
Synonyms

3(2(ethylsulfanyl)ethyl)6methyl4(4(dimethylamino)phenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethylsulfanylethyl)6Omethyl4(4(dimethylamino)phenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)N(C)C)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC26H34N2O5Sc173413123326(31)2116(3)27191415(2)20(25(30)326)24(29)23(19)22(21)1781018(11917)28(4)5h81115202227H71214H216H3
MFCD04057098
ZINC000020190575
ZINC000033787119

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Available files

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