Vitas-M small molecule compound
(4E)-4-[(5-fluoro-2-methoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Catalog ID
STK636524
SMILES COc1ccc(cc1/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)C)/O)F
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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(11-4-3-7-22-9-11)15(18(27)19(25)28)17(26)13-8-12(21)5-6-14(13)29-2/h3-9,16,26H,1-2H3/b17-15+InChIKey
YJHNPBZGKNVZOW-BMRADRMJSA-NSynonyms
952000-68-9(4E)4((5fluoro2methoxyphenyl)(hydroxy)methylidene)1(5methyl134thiadiazol2yl)5(pyridin3yl)pyrrolidine23dione
(4E)4((5fluoro2methoxyphenyl)hydroxymethylidene)1(5methyl134thiadiazol2yl)5pyridin3ylpyrrolidine23dione
952000689
CC1=NN=C(S1)N2C(C(=C(C3=C(C=CC(=C3)F)OC)O)C(=O)C2=O)C4=CN=CC=C4
COc1ccc(cc1C(=C1C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)C)O)F
InChI=1SC20H15FN4O4Sc110232420(3010)2516(1143722911)15(18(27)19(25)28)17(26)13812(21)5614(13)292h391626H12H3b1715+
MFCD18161083
ZINC000102740844
ZINC000102740845
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