Vitas-M small molecule compound
(4E)-5-(4-fluorophenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Catalog ID
STK584819
SMILES CSc1nnc(s1)N1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=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 C21H16FN3O3S2 MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN3O3S2/c1-11-3-5-13(6-4-11)17(26)15-16(12-7-9-14(22)10-8-12)25(19(28)18(15)27)20-23-24-21(29-2)30-20/h3-10,16,26H,1-2H3/b17-15+InChIKey
PXDFJVDFKOXMAE-BMRADRMJSA-NSynonyms
(4E)5(4fluorophenyl)4(hydroxy(4methylphenyl)methylidene)1(5(methylsulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)5(4fluorophenyl)4(hydroxy(4methylphenyl)methylidene)1(5methylsulfanyl134thiadiazol2yl)pyrrolidine23dione
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)SC)C4=CC=C(C=C4)F)O
CSc1nnc(s1)N1C(c2ccc(cc2)F)C(=C(c2ccc(cc2)C)O)C(=O)C1=O
InChI=1SC21H16FN3O3S2c1113513(6411)17(26)1516(127914(22)10812)25(19(28)18(15)27)20232421(292)3020h3101626H12H3b1715+
MFCD07208934
ZINC000102597556
ZINC000102597560
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