Vitas-M small molecule compound

4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol

Catalog ID
STL421927
SMILES Brc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)c1ccc2c(c1)OCCO2

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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 C21H16BrN3O3S MW 470.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O3S/c22-13-3-1-12(2-4-13)15-11-29-21(24-15)19-16(26)10-25(20(19)23)14-5-6-17-18(9-14)28-8-7-27-17/h1-6,9,11,23,26H,7-8,10H2/b23-20-
InChIKey
PEKRDUMLEOHYNL-ATJXCDBQSA-N
Synonyms
428512-71-4
4(4(4bromophenyl)13thiazol2yl)1(23dihydro14benzodioxin6yl)5imino25dihydro1Hpyrrol3ol
428512714
MFCD30707839
ZINC000252540353

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.