Vitas-M small molecule compound

N-[(5Z)-5-{3-bromo-4-[(4-nitrobenzyl)oxy]benzylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]acetamide

Catalog ID
STK036538
SMILES CC(=O)NC1=NC(=O)/C(=C/c2ccc(c(c2)Br)OCc2ccc(cc2)[N+](=O)[O-])/S1

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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 C19H14BrN3O5S MW 476.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrN3O5S/c1-11(24)21-19-22-18(25)17(29-19)9-13-4-7-16(15(20)8-13)28-10-12-2-5-14(6-3-12)23(26)27/h2-9H,10H2,1H3,(H,21,22,24,25)/b17-9-
InChIKey
QWFPFWXHCHURKA-MFOYZWKCSA-N
Synonyms

CC(=O)NC1=NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))Br)S1
CC(=O)NC1=NC(=O)C(=Cc2ccc(c(c2)Br)OCc2ccc(cc2)(N+)(=O)(O))S1
InChI=1SC19H14BrN3O5Sc111(24)21192218(25)17(2919)9134716(15(20)813)2810122514(6312)23(26)27h29H10H21H3(H21222425)b179
MFCD03552354
N((5Z)5((3BROMO4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)4OXO13THIAZOL2YL)ACETAMIDE
N((5Z)5(3BROMO4((4NITROBENZYL)OXY)BENZYLIDENE)4OXO45DIHYDRO13THIAZOL2YL)ACETAMIDE
STK036538
ZINC000001112558
ZINC01112558
ZINC1112558

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Available files

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