Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(4-chlorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK800555
SMILES Clc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2Cl)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 C28H17Cl2N3O4S2 MW 594.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H17Cl2N3O4S2/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,14H2InChIKey
NKWDMLCBLDGQAE-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)2(4CHLOROPHENYL)1(5((2CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)4HYDROXY2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)5(4chlorophenyl)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=C6Cl)O
InChI=1SC28H17Cl2N3O4S2c291811915(101218)2322(24(34)211316524820(16)3721)25(35)26(36)33(23)27313228(3927)381417613719(17)30h1132335H14H2
MFCD04148028
ZINC000008384047
ZINC000008384052
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