Vitas-M small molecule compound
(4E)-5-(4-bromophenyl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL047713
SMILES Fc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)Br)N(C(=O)C1=O)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 C20H13BrFN3O3S MW 474.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrFN3O3S/c1-10-23-24-20(29-10)25-16(11-2-6-13(21)7-3-11)15(18(27)19(25)28)17(26)12-4-8-14(22)9-5-12/h2-9,16,26H,1H3/b17-15+InChIKey
MTFWQOLVDXOMGG-BMRADRMJSA-NSynonyms
371236-70-3(4E)5(4bromophenyl)4((4fluorophenyl)(hydroxy)methylidene)1(5methyl134thiadiazol2yl)pyrrolidine23dione
(4E)5(4BROMOPHENYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)1(5METHYL134THIADIAZOL2YL)PYRROLIDINE23DIONE
371236703
CC1=NN=C(S1)N2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=C(C=C4)Br
Fc1ccc(cc1)C(=C1C(c2ccc(cc2)Br)N(C(=O)C1=O)c1nnc(s1)C)O
InChI=1SC20H13BrFN3O3Sc110232420(2910)2516(112613(21)7311)15(18(27)19(25)28)17(26)124814(22)9512h291626H1H3b1715+
MFCD03800138
ZINC000102882683
ZINC000102882685
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