Vitas-M small molecule compound

4-(1-benzofuran-2-ylcarbonyl)-5-(4-chlorophenyl)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK799576
SMILES Clc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2F)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 C28H17ClFN3O4S2 MW 578.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H17ClFN3O4S2/c29-18-11-9-15(10-12-18)23-22(24(34)21-13-16-5-2-4-8-20(16)37-21)25(35)26(36)33(23)27-31-32-28(39-27)38-14-17-6-1-3-7-19(17)30/h1-13,23,35H,14H2
InChIKey
UJGNUEZDJMMGCF-UHFFFAOYSA-N
Synonyms

3(1BENZOFURAN2CARBONYL)2(4CHLOROPHENYL)1(5((2FLUOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)4HYDROXY2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)5(4chlorophenyl)1(5((2fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy15dihydro2Hpyrrol2one
C1=CC=C2C(=C1)C=C(O2)C(=O)C3=C(C(=O)N(C3C4=CC=C(C=C4)Cl)C5=NN=C(S5)SCC6=CC=CC=C6F)O
InChI=1SC28H17ClFN3O4S2c291811915(101218)2322(24(34)211316524820(16)3721)25(35)26(36)33(23)27313228(3927)381417613719(17)30h1132335H14H2
MFCD04088627
ZINC000008383447
ZINC000008383450

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Available files

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