Vitas-M small molecule compound
(4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL043354
SMILES COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)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 C28H23ClN2O6S MW 551.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN2O6S/c1-14-5-10-18-21(11-14)38-28(30-18)31-23(16-12-19(35-2)26(37-4)20(13-16)36-3)22(25(33)27(31)34)24(32)15-6-8-17(29)9-7-15/h5-13,23,32H,1-4H3/b24-22+InChIKey
LKYVNJIAFDSEGD-ZNTNEXAZSA-NSynonyms
(4E)4((4chlorophenyl)(hydroxy)methylidene)1(6methyl13benzothiazol2yl)5(345trimethoxyphenyl)pyrrolidine23dione
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(6METHYL13BENZOTHIAZOL2YL)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
4((4CHLOROPHENYL)CARBONYL)3HYDROXY1(6METHYLBENZOTHIAZOL2YL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)Cl)O)C(=O)C3=O)C5=CC(=C(C(=C5)OC)OC)OC
COc1c(OC)cc(cc1OC)C1C(=C(c2ccc(cc2)Cl)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC28H23ClN2O6Sc1145101821(1114)3828(3018)3123(161219(352)26(374)20(1316)363)22(25(33)27(31)34)24(32)156817(29)9715h5132332H14H3b2422+
MFCD03814867
ZINC000102873286
ZINC000102873290
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.