Vitas-M small molecule compound
3-[4-(methylsulfanyl)benzylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
Catalog ID
STK742711
SMILES CSc1ccc(cc1)C=C1C(=O)OC2(OC1=O)CCCCC2
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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 C17H18O4S MW 318.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18O4S/c1-22-13-7-5-12(6-8-13)11-14-15(18)20-17(21-16(14)19)9-3-2-4-10-17/h5-8,11H,2-4,9-10H2,1H3InChIKey
PVBVTSBZGUUZKE-UHFFFAOYSA-NSynonyms
443669-00-915DIOXASPIRO(55)UNDECANE24DIONE3(4METHYLSULFANYLBENZYLIDENE)
3((4methylsulfanylphenyl)methylidene)15dioxaspiro(55)undecane24dione
3(4(methylsulfanyl)benzylidene)15dioxaspiro(55)undecane24dione
3(4(METHYLTHIO)BENZYLIDENE)15DIOXASPIRO(55)UNDECANE24DIONE
443669009
9((4METHYLSULFANYLPHENYL)METHYLIDENE)711DIOXASPIRO(55)UNDECANE810DIONE
CSC1=CC=C(C=C1)C=C2C(=O)OC3(CCCCC3)OC2=O
InChI=1SC17H18O4Sc122137512(6813)111415(18)2017(2116(14)19)93241017h5811H24910H21H3
MFCD01970524
ZINC000004151846
ZINC04151846
ZINC4151846
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