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N-[(E)-1-(4-bromophenyl)-3-oxidanylidene-3-piperazin-1-yl-prop-1-en-2-yl]-4-methyl-benzamide
SpectraBase Compound ID B4QuCphJjxn
InChI InChI=1S/C21H22BrN3O2/c1-15-2-6-17(7-3-15)20(26)24-19(14-16-4-8-18(22)9-5-16)21(27)25-12-10-23-11-13-25/h2-9,14,23H,10-13H2,1H3,(H,24,26)/b19-14+
InChIKey HEPKJXVWKDXJES-XMHGGMMESA-N
Mol Weight 428.33 g/mol
Molecular Formula C21H22BrN3O2
Exact Mass 427.08954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ijzf70QqTtz
Name N-[(E)-1-(4-bromophenyl)-3-oxidanylidene-3-piperazin-1-yl-prop-1-en-2-yl]-4-methyl-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22BrN3O2
InChI InChI=1S/C21H22BrN3O2/c1-15-2-6-17(7-3-15)20(26)24-19(14-16-4-8-18(22)9-5-16)21(27)25-12-10-23-11-13-25/h2-9,14,23H,10-13H2,1H3,(H,24,26)/b19-14+
InChIKey HEPKJXVWKDXJES-XMHGGMMESA-N
Molecular Weight 428.330 g/mol
SMILES N(C(=O)c1ccc(cc1)C)\C(C(N1CCNCC1)=O)=C\c1ccc(cc1)Br
SPLASH splash10-014l-9701000000-5b7f9770a16cad2bc35e
Synonyms N-[(E)-1-(4-bromophenyl)-3-oxo-3-(1-piperazinyl)prop-1-en-2-yl]-4-methylbenzamide N-[(E)-1-(4-bromophenyl)-3-oxo-3-piperazin-1-ylprop-1-en-2-yl]-4-methylbenzamide N-[(E)-2-(4-bromophenyl)-1-(piperazine-1-carbonyl)vinyl]-4-methyl-benzamide
Wiley ID 1438743