Vitas-M small molecule compound

(4E)-5-(2,3-dimethoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione

Catalog ID
STK562200
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1cccc(c1OC)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 C28H23FN2O6S MW 534.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23FN2O6S/c1-4-37-17-12-13-19-21(14-17)38-28(30-19)31-23(18-6-5-7-20(35-2)26(18)36-3)22(25(33)27(31)34)24(32)15-8-10-16(29)11-9-15/h5-14,23,32H,4H2,1-3H3/b24-22+
InChIKey
RXDZYEUNFQQHQW-ZNTNEXAZSA-N
Synonyms
514192-99-5
(4E)5(23dimethoxyphenyl)1(6ethoxy13benzothiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)pyrrolidine23dione
(4E)5(23DIMETHOXYPHENYL)1(6ETHOXY13BENZOTHIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
5(23DIMETHOXYPHENYL)1(6ETHOXYBENZOTHIAZOL2YL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
514192995
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)F)O)C(=O)C3=O)C5=C(C(=CC=C5)OC)OC
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc(cc2)F)O)C1c1cccc(c1OC)OC
InChI=1SC28H23FN2O6Sc14371712131921(1417)3828(3019)3123(1865720(352)26(18)363)22(25(33)27(31)34)24(32)1581016(29)11915h5142332H4H213H3b2422+
MFCD03796378
ZINC000102510437
ZINC000102510447

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.