Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-5-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK515398
SMILES COc1cc(cc(c1O)Br)C1N(c2nnc(s2)C)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)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 C23H16BrN3O6S MW 542.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrN3O6S/c1-10-25-26-23(34-10)27-18(12-7-13(24)19(28)15(9-12)32-2)17(21(30)22(27)31)20(29)16-8-11-5-3-4-6-14(11)33-16/h3-9,18,28,30H,1-2H3InChIKey
OSNAYSHYXXHYLI-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)2(3BROMO4HYDROXY5METHOXYPHENYL)4HYDROXY1(5METHYL134THIADIAZOL2YL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)5(3bromo4hydroxy5methoxyphenyl)3hydroxy1(5methyl134thiadiazol2yl)15dihydro2Hpyrrol2one
CC1=NN=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC(=C(C(=C5)Br)O)OC
InChI=1SC23H16BrN3O6Sc110252623(3410)2718(12713(24)19(28)15(912)322)17(21(30)22(27)31)20(29)16811534614(11)3316h39182830H12H3
MFCD06280200
ZINC000098046547
ZINC000098046548
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