Vitas-M small molecule compound
(4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL047529
SMILES CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OCC
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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 C28H23ClN2O5S MW 535.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN2O5S/c1-3-35-19-11-7-16(8-12-19)24-23(25(32)17-5-9-18(29)10-6-17)26(33)27(34)31(24)28-30-21-14-13-20(36-4-2)15-22(21)37-28/h5-15,24,32H,3-4H2,1-2H3/b25-23+InChIKey
WSYBYPDDOWEQBK-WJTDDFOZSA-NSynonyms
514193-11-4(4E)4((4chlorophenyl)(hydroxy)methylidene)1(6ethoxy13benzothiazol2yl)5(4ethoxyphenyl)pyrrolidine23dione
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(6ETHOXY13BENZOTHIAZOL2YL)5(4ETHOXYPHENYL)PYRROLIDINE23DIONE
4((4CHLOROPHENYL)CARBONYL)1(6ETHOXYBENZOTHIAZOL2YL)5(4ETHOXYPHENYL)3HYDROXY3PYRROLIN2ONE
514193114
CCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)OCC
CCOc1ccc(cc1)C1C(=C(c2ccc(cc2)Cl)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OCC
InChI=1SC28H23ClN2O5Sc13351911716(81219)2423(25(32)175918(29)10617)26(33)27(34)31(24)283021141320(3642)1522(21)3728h5152432H34H212H3b2523+
MFCD03802388
ZINC000102882862
ZINC000102882863
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.