Vitas-M small molecule compound
4-bromo-2-[(E)-{2-[{[3-(morpholin-4-ium-4-yl)propyl]amino}(oxo)acetyl]hydrazinylidene}methyl]phenolate
Catalog ID
STL048229
SMILES O=C(C(=O)N/N=C/c1cc(Br)ccc1[O-])NCCC[NH+]1CCOCC1
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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 C16H21BrN4O4 MW 413.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21BrN4O4/c17-13-2-3-14(22)12(10-13)11-19-20-16(24)15(23)18-4-1-5-21-6-8-25-9-7-21/h2-3,10-11,22H,1,4-9H2,(H,18,23)(H,20,24)/b19-11+InChIKey
SGZABQNIUFRZED-YBFXNURJSA-NSynonyms
575463-43-34bromo2((E)((2(3morpholin4ium4ylpropylamino)2oxoacetyl)hydrazinylidene)methyl)phenolate
4bromo2((E)(2(((3(morpholin4ium4yl)propyl)amino)(oxo)acetyl)hydrazinylidene)methyl)phenolate
575463433
C1COCC(NH+)1CCCNC(=O)C(=O)NN=CC2=C(C=CC(=C2)Br)(O)
InChI=1SC16H21BrN4O4c17132314(22)12(1013)11192016(24)15(23)184152168259721h23101122H149H2(H1823)(H2024)b1911+
MFCD04026913
O=C(C(=O)NN=Cc1cc(Br)ccc1(O))NCCC(NH+)1CCOCC1
ZINC000019831268
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