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N-(2-(4-benzylpiperazin-1-yl)-5-bromophenyl)-2-imino-2H-chromene-3-carboxamide
SpectraBase Compound ID IqCylnWghWZ
InChI InChI=1S/C27H25BrN4O2/c28-21-10-11-24(32-14-12-31(13-15-32)18-19-6-2-1-3-7-19)23(17-21)30-27(33)22-16-20-8-4-5-9-25(20)34-26(22)29/h1-11,16-17,29H,12-15,18H2,(H,30,33)
InChIKey HSSQZTUBGOSCDN-UHFFFAOYSA-N
Mol Weight 517.43 g/mol
Molecular Formula C27H25BrN4O2
Exact Mass 516.116089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ba0Xzs1q52
Name N-(2-(4-Benzylpiperazin-1-yl)-5-bromophenyl)-2-imino-2H-chromene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H25BrN4O2
InChI InChI=1S/C27H25BrN4O2/c28-21-10-11-24(32-14-12-31(13-15-32)18-19-6-2-1-3-7-19)23(17-21)30-27(33)22-16-20-8-4-5-9-25(20)34-26(22)29/h1-11,16-17,29H,12-15,18H2,(H,30,33)
InChIKey HSSQZTUBGOSCDN-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.bmc.2013.01.064
Molecular Weight 517.427 g/mol
SMILES N(C(C=1C(Oc2ccccc2C1)=N)=O)c1c(ccc(c1)Br)N1CCN(CC1)Cc1ccccc1
SPLASH splash10-01b9-4803090000-75dcba14413ffefff847
Source of Spectrum G2-21-2408-6a
Synonyms N-[5-bromo-2-[4-(phenylmethyl)-1-piperazinyl]phenyl]-2-imino-1-benzopyran-3-carboxamide N-[2-(4-benzylpiperazin-1-yl)-5-bromophenyl]-2-iminochromene-3-carboxamide N-[2-(4-benzylpiperazin-1-yl)-5-bromo-phenyl]-2-imino-chromene-3-carboxamide 2-Azanylidene-N-[5-bromanyl-2-[4-(phenylmethyl)piperazin-1-yl]phenyl]chromene-3-carboxamide
Wiley ID 1754116