Vitas-M small molecule compound
3-[2-(ethylsulfanyl)ethyl] 6-methyl 4-(4-ethylphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK407479
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)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 C26H33NO5S MW 471.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO5S/c1-6-17-8-10-18(11-9-17)22-21(26(30)32-12-13-33-7-2)16(4)27-19-14-15(3)20(25(29)31-5)24(28)23(19)22/h8-11,15,20,22,27H,6-7,12-14H2,1-5H3InChIKey
NZKVCJDZCQWMLF-UHFFFAOYSA-NSynonyms
3(2(ethylsulfanyl)ethyl)6methyl4(4ethylphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethylsulfanylethyl)6Omethyl4(4ethylphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCC1=CC=C(C=C1)C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OCCSCC)C
InChI=1SC26H33NO5Sc161781018(11917)2221(26(30)3212133372)16(4)27191415(3)20(25(29)315)24(28)23(19)22h81115202227H671214H215H3
MFCD04057128
ZINC000020192234
ZINC000102557073
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