Vitas-M small molecule compound
(4E)-4-[(3-fluoro-4-methoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK631838
SMILES COc1ccc(cc1F)/C(=C/1\C(=O)C(=O)N(C1c1ccccn1)c1nnc(s1)C)/O
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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 C20H15FN4O4S MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN4O4S/c1-10-23-24-20(30-10)25-16(13-5-3-4-8-22-13)15(18(27)19(25)28)17(26)11-6-7-14(29-2)12(21)9-11/h3-9,16,26H,1-2H3/b17-15+InChIKey
YKQMAXICVYCQET-BMRADRMJSA-NSynonyms
951954-79-3(4E)4((3fluoro4methoxyphenyl)(hydroxy)methylidene)1(5methyl134thiadiazol2yl)5(pyridin2yl)pyrrolidine23dione
(4E)4((3fluoro4methoxyphenyl)hydroxymethylidene)1(5methyl134thiadiazol2yl)5pyridin2ylpyrrolidine23dione
951954793
CC1=NN=C(S1)N2C(C(=C(C3=CC(=C(C=C3)OC)F)O)C(=O)C2=O)C4=CC=CC=N4
COc1ccc(cc1F)C(=C1C(=O)C(=O)N(C1c1ccccn1)c1nnc(s1)C)O
InChI=1SC20H15FN4O4Sc110232420(3010)2516(1353482213)15(18(27)19(25)28)17(26)116714(292)12(21)911h391626H12H3b1715+
MFCD18159589
ZINC000102735808
ZINC000102735811
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