Vitas-M small molecule compound
(4E)-5-[3-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK569956
SMILES O/C(=C/1\C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1nccs1)/c1ccc2c(c1)OCCO2
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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 C29H22N2O6S MW 526.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N2O6S/c32-26(20-9-10-22-23(16-20)36-13-12-35-22)24-25(31(28(34)27(24)33)29-30-11-14-38-29)19-7-4-8-21(15-19)37-17-18-5-2-1-3-6-18/h1-11,14-16,25,32H,12-13,17H2/b26-24+InChIKey
IFWYFQMLXCWIDV-SHHOIMCASA-NSynonyms
620571-52-0(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3PHENYLMETHOXYPHENYL)1(13THIAZOL2YL)PYRROLIDINE23DIONE
(4E)5(3(benzyloxy)phenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(13thiazol2yl)pyrrolidine23dione
620571520
C1COC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC=CS4)C5=CC(=CC=C5)OCC6=CC=CC=C6)O
InChI=1SC29H22N2O6Sc3226(209102223(1620)3613123522)2425(31(28(34)27(24)33)293011143829)1974821(1519)3717185213618h11114162532H121317H2b2624+
MFCD07209026
OC(=C1C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1nccs1)c1ccc2c(c1)OCCO2
ZINC000102654779
ZINC000102654781
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