Vitas-M small molecule compound
5-(4-bromophenyl)-4-[(4-chlorophenyl)sulfonyl]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK515803
SMILES Brc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2F)C(=O)C(=C1S(=O)(=O)c1ccc(cc1)Cl)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 C25H16BrClFN3O4S3 MW 652.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16BrClFN3O4S3/c26-16-7-5-14(6-8-16)20-22(38(34,35)18-11-9-17(27)10-12-18)21(32)23(33)31(20)24-29-30-25(37-24)36-13-15-3-1-2-4-19(15)28/h1-12,20,32H,13H2InChIKey
XESPKLUUGSCLAB-UHFFFAOYSA-NSynonyms
2(4bromophenyl)3(4chlorophenyl)sulfonyl1(5((2fluorophenyl)methylsulfanyl)134thiadiazol2yl)4hydroxy2Hpyrrol5one
5(4bromophenyl)4((4chlorophenyl)sulfonyl)1(5((2fluorobenzyl)sulfanyl)134thiadiazol2yl)3hydroxy15dihydro2Hpyrrol2one
C1=CC=C(C(=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)S(=O)(=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Br)F
InChI=1SC25H16BrClFN3O4S3c26167514(6816)2022(38(3435)1811917(27)101218)21(32)23(33)31(20)24293025(3724)361315312419(15)28h1122032H13H2
MFCD06645383
ZINC000098047909
ZINC000098047910
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