Vitas-M small molecule compound
(4E)-5-(2,3-dimethoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL151189
SMILES COc1cccc(c1OC)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
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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/c1-14-12-15(2)22-20(13-14)37-28(30-22)31-23(18-6-5-7-19(35-3)26(18)36-4)21(25(33)27(31)34)24(32)16-8-10-17(29)11-9-16/h5-13,23,32H,1-4H3/b24-21+InChIKey
KFEAGRQIINKBPN-DARPEHSRSA-NSynonyms
514193-91-0(4E)5(23dimethoxyphenyl)1(46dimethyl13benzothiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)pyrrolidine23dione
(4E)5(23DIMETHOXYPHENYL)1(46DIMETHYL13BENZOTHIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
5(23DIMETHOXYPHENYL)1(46DIMETHYLBENZOTHIAZOL2YL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
514193910
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
COc1cccc(c1OC)C1C(=C(c2ccc(cc2)F)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC28H23FN2O5Sc1141215(2)2220(1314)3728(3022)3123(1865719(353)26(18)364)21(25(33)27(31)34)24(32)1681017(29)11916h5132332H14H3b2421+
MFCD03803300
ZINC000102933107
ZINC000102933109
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.