Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-phenylethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK568074
SMILES O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1CCc1ccccc1)c1cccs1
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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 C25H21NO5S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO5S/c27-23(17-8-9-18-19(15-17)31-13-12-30-18)21-22(20-7-4-14-32-20)26(25(29)24(21)28)11-10-16-5-2-1-3-6-16/h1-9,14-15,22,27H,10-13H2/b23-21+InChIKey
ZRPDKZKFJPKDFM-XTQSDGFTSA-NSynonyms
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(2phenylethyl)5(thiophen2yl)pyrrolidine23dione
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(2phenylethyl)5thiophen2ylpyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1PHENETHYL5THIOPHEN2YLPYRROLIDINE23DIONE
C1COC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CCC4=CC=CC=C4)C5=CC=CS5)O
InChI=1SC25H21NO5Sc2723(17891819(1517)3113123018)2122(2074143220)26(25(29)24(21)28)1110165213616h1914152227H1013H2b2321+
MFCD05726460
O=C1C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C(N1CCc1ccccc1)c1cccs1
ZINC000102550583
ZINC000102550588
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