Vitas-M small molecule compound
(4E)-4-[(5-fluoro-2-methoxyphenyl)(hydroxy)methylidene]-5-(2-methoxyphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK637250
SMILES COc1ccccc1C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1cc(F)ccc1OC)/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 C22H18FN3O5S MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3O5S/c1-11-24-25-22(32-11)26-18(13-6-4-5-7-15(13)30-2)17(20(28)21(26)29)19(27)14-10-12(23)8-9-16(14)31-3/h4-10,18,27H,1-3H3/b19-17+InChIKey
VMDKAFGDYXSUFO-HTXNQAPBSA-NSynonyms
951949-00-1(4E)4((5fluoro2methoxyphenyl)(hydroxy)methylidene)5(2methoxyphenyl)1(5methyl134thiadiazol2yl)pyrrolidine23dione
(4E)4((5fluoro2methoxyphenyl)hydroxymethylidene)5(2methoxyphenyl)1(5methyl134thiadiazol2yl)pyrrolidine23dione
951949001
CC1=NN=C(S1)N2C(C(=C(C3=C(C=CC(=C3)F)OC)O)C(=O)C2=O)C4=CC=CC=C4OC
COc1ccccc1C1N(c2nnc(s2)C)C(=O)C(=O)C1=C(c1cc(F)ccc1OC)O
InChI=1SC22H18FN3O5Sc111242522(3211)2618(13645715(13)302)17(20(28)21(26)29)19(27)141012(23)8916(14)313h4101827H13H3b1917+
MFCD18161321
ZINC000102741358
ZINC000102741360
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