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N-(2-(4-(3-Cyanobenzyl)piperazin-1-yl)-5-bromophenyl)-2-(phenylimino)-2H-chromene-3-carboxamide
SpectraBase Compound ID EBpV5FKiSCY
InChI InChI=1S/C34H28BrN5O2/c35-27-13-14-31(40-17-15-39(16-18-40)23-25-8-6-7-24(19-25)22-36)30(21-27)38-33(41)29-20-26-9-4-5-12-32(26)42-34(29)37-28-10-2-1-3-11-28/h1-14,19-21H,15-18,23H2,(H,38,41)/b37-34-
InChIKey GRWKMHPYZNLNJQ-LLLYXHGFSA-N
Mol Weight 618.5 g/mol
Molecular Formula C34H28BrN5O2
Exact Mass 617.142638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbjR44fkyfW
Name N-(2-(4-(3-Cyanobenzyl)piperazin-1-yl)-5-bromophenyl)-2-(phenylimino)-2H-chromene-3-carboxamide
Alternate Name(s) (Z)-N-(5-bromo-2-(4-(3-cyanobenzyl)piperazin-1-yl)phenyl)-2-(phenylimino)-2H-chromene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H28BrN5O2
InChI InChI=1S/C34H28BrN5O2/c35-27-13-14-31(40-17-15-39(16-18-40)23-25-8-6-7-24(19-25)22-36)30(21-27)38-33(41)29-20-26-9-4-5-12-32(26)42-34(29)37-28-10-2-1-3-11-28/h1-14,19-21H,15-18,23H2,(H,38,41)/b37-34-
InChIKey GRWKMHPYZNLNJQ-LLLYXHGFSA-N
Literature Reference DOI 10.1016/j.bmc.2013.01.064
Molecular Weight 618.535 g/mol
SMILES N(C(C1=Cc2c(O\C1=N\c1ccccc1)cccc2)=O)c1c(N2CCN(CC2)Cc2cccc(c2)C#N)ccc(Br)c1
SPLASH splash10-00r2-0191107000-bdb405c06072515e4995
Source of Spectrum G2-21-2409-9c
Wiley ID 1754125