Vitas-M small molecule compound
(4E)-5-(2,5-dimethoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL037348
SMILES COc1ccc(c(c1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C)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 C28H23FN2O5S MW 518.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23FN2O5S/c1-14-11-15(2)23-21(12-14)37-28(30-23)31-24(19-13-18(35-3)9-10-20(19)36-4)22(26(33)27(31)34)25(32)16-5-7-17(29)8-6-16/h5-13,24,32H,1-4H3/b25-22+InChIKey
WHOXZLUZWAOROY-YYDJUVGSSA-NSynonyms
514193-93-2(4E)5(25dimethoxyphenyl)1(46dimethyl13benzothiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)pyrrolidine23dione
(4E)5(25DIMETHOXYPHENYL)1(46DIMETHYL13BENZOTHIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
5(25DIMETHOXYPHENYL)1(46DIMETHYLBENZOTHIAZOL2YL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
514193932
CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C4=CC=C(C=C4)F)O)C(=O)C3=O)C5=C(C=CC(=C5)OC)OC)C
COc1ccc(c(c1)C1C(=C(c2ccc(cc2)F)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C)OC
InChI=1SC28H23FN2O5Sc1141115(2)2321(1214)3728(3023)3124(191318(353)91020(19)364)22(26(33)27(31)34)25(32)165717(29)8616h5132432H14H3b2522+
MFCD03795639
ZINC000102858614
ZINC000102858617
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.