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N-(5-Bromo-2-(4-(3-cyanopropyl)piperazin-1-yl)phenyl)-2-(phenylimino)-2H-chromene-3-carboxamide
SpectraBase Compound ID 6wUFSdbKSm8
InChI InChI=1S/C30H28BrN5O2/c31-23-12-13-27(36-18-16-35(17-19-36)15-7-6-14-32)26(21-23)34-29(37)25-20-22-8-4-5-11-28(22)38-30(25)33-24-9-2-1-3-10-24/h1-5,8-13,20-21H,6-7,15-19H2,(H,34,37)/b33-30-
InChIKey RSUBWEPWSHIRRG-MEIHLTSWSA-N
Mol Weight 570.49 g/mol
Molecular Formula C30H28BrN5O2
Exact Mass 569.142638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BoU4FJVACbF
Name N-(5-Bromo-2-(4-(3-cyanopropyl)piperazin-1-yl)phenyl)-2-(phenylimino)-2H-chromene-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28BrN5O2
InChI InChI=1S/C30H28BrN5O2/c31-23-12-13-27(36-18-16-35(17-19-36)15-7-6-14-32)26(21-23)34-29(37)25-20-22-8-4-5-11-28(22)38-30(25)33-24-9-2-1-3-10-24/h1-5,8-13,20-21H,6-7,15-19H2,(H,34,37)/b33-30-
InChIKey RSUBWEPWSHIRRG-MEIHLTSWSA-N
Literature Reference DOI 10.1016/j.bmc.2013.01.064
Molecular Weight 570.491 g/mol
SMILES N(C(C=1\C(Oc2ccccc2C1)=N\c1ccccc1)=O)c1c(ccc(Br)c1)N1CCN(CC1)CCCC#N
SPLASH splash10-00dj-1091170000-a5b2df77c7129080e5ef
Source of Spectrum G2-21-2409-9b
Synonyms (Z)-N-(5-bromo-2-(4-(3-cyanopropyl)piperazin-1-yl)phenyl)-2-(phenylimino)-2H-chromene-3-carboxamide
Wiley ID 1754124