Vitas-M small molecule compound

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

Catalog ID
STL149358
SMILES CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)F)\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 C28H23FN2O5S MW 518.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23FN2O5S/c1-4-36-20-12-8-17(14-21(20)35-3)24-23(25(32)16-6-9-18(29)10-7-16)26(33)27(34)31(24)28-30-19-11-5-15(2)13-22(19)37-28/h5-14,24,32H,4H2,1-3H3/b25-23+
InChIKey
WAPPVURPGKXBEW-WJTDDFOZSA-N
Synonyms
514189-18-5
(4E)5(4ethoxy3methoxyphenyl)4((4fluorophenyl)(hydroxy)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
(4E)5(4ETHOXY3METHOXYPHENYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)1(6METHYL13BENZOTHIAZOL2YL)PYRROLIDINE23DIONE
5(4ETHOXY3METHOXYPHENYL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY1(6METHYLBENZOTHIAZOL2YL)3PYRROLIN2ONE
514189185
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC=C(C=C3)F)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)C)OC
CCOc1ccc(cc1OC)C1C(=C(c2ccc(cc2)F)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC28H23FN2O5Sc14362012817(1421(20)353)2423(25(32)166918(29)10716)26(33)27(34)31(24)28301911515(2)1322(19)3728h5142432H4H213H3b2523+
MFCD03793701
ZINC000102928580
ZINC000102928584

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Available files

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