Vitas-M small molecule compound
(4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK570666
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)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 C33H32N2O6S MW 584.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N2O6S/c1-4-5-6-14-40-24-9-7-8-20(17-24)29-28(30(36)21-10-13-26-22(16-21)15-19(2)41-26)31(37)32(38)35(29)33-34-25-12-11-23(39-3)18-27(25)42-33/h7-13,16-19,29,36H,4-6,14-15H2,1-3H3/b30-28+InChIKey
FRCSDTSAPPYJJD-SJCQXOIGSA-NSynonyms
893699-38-2(4E)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(6methoxy13benzothiazol2yl)5(3(pentyloxy)phenyl)pyrrolidine23dione
(4E)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(6methoxy13benzothiazol2yl)5(3pentoxyphenyl)pyrrolidine23dione
893699382
CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)OC
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC
InChI=1SC33H32N2O6Sc145614402497820(1724)2928(30(36)2110132622(1621)1519(2)4126)31(37)32(38)35(29)333425121123(393)1827(25)4233h71316192936H461415H213H3b3028+
MFCD07207939
ZINC000102563568
ZINC000102655757
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.