Vitas-M small molecule compound
3-[2-(ethylsulfanyl)ethyl] 6-methyl 2,7-dimethyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK407508
SMILES CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc3c1cccc3)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 C28H31NO5S MW 493.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO5S/c1-5-35-14-13-34-28(32)23-17(3)29-21-15-16(2)22(27(31)33-4)26(30)25(21)24(23)20-12-8-10-18-9-6-7-11-19(18)20/h6-12,16,22,24,29H,5,13-15H2,1-4H3InChIKey
ZVYXALBLXASFEL-UHFFFAOYSA-NSynonyms
3(2(ethylsulfanyl)ethyl)6methyl27dimethyl4(naphthalen1yl)5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethylsulfanylethyl)6Omethyl27dimethyl4naphthalen1yl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCSCCOC(=O)C1=C(NC2=C(C1C3=CC=CC4=CC=CC=C43)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC28H31NO5Sc153514133428(32)2317(3)29211516(2)22(27(31)334)26(30)25(21)24(23)2012810189671119(18)20h61216222429H51315H214H3
MFCD04057157
ZINC000020190862
ZINC000035877286
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