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5-[4-[(5-oxidanylidene-3,4-dihydropyrrol-2-yl)-phenyl-amino]but-2-ynyl-phenyl-amino]-3,4-dihydropyrrol-2-one
SpectraBase Compound ID ADeZjomQjzN
InChI InChI=1S/C24H22N4O2/c29-23-15-13-21(25-23)27(19-9-3-1-4-10-19)17-7-8-18-28(20-11-5-2-6-12-20)22-14-16-24(30)26-22/h1-6,9-12H,13-18H2
InChIKey NCRZMCJXGFHYOJ-UHFFFAOYSA-N
Mol Weight 398.47 g/mol
Molecular Formula C24H22N4O2
Exact Mass 398.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dfsiz17mPbO
Name 5-[4-[(5-oxidanylidene-3,4-dihydropyrrol-2-yl)-phenyl-amino]but-2-ynyl-phenyl-amino]-3,4-dihydropyrrol-2-one
CAS Registry Number 75812-70-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N4O2
InChI InChI=1S/C24H22N4O2/c29-23-15-13-21(25-23)27(19-9-3-1-4-10-19)17-7-8-18-28(20-11-5-2-6-12-20)22-14-16-24(30)26-22/h1-6,9-12H,13-18H2
InChIKey NCRZMCJXGFHYOJ-UHFFFAOYSA-N
Molecular Weight 398.466 g/mol
SMILES C1(=NC(=O)CC1)N(CC#CCN(C1=NC(=O)CC1)c1ccccc1)c1ccccc1
SPLASH splash10-00mk-4920000000-d936b62a017a9dd6caaa
Source of Spectrum J-46-1085-0
Synonyms 5-[N-[4-(N-(5-keto-1-pyrrolin-2-yl)anilino)but-2-ynyl]anilino]-1-pyrrolin-2-one 5-[N-[4-(N-(5-oxo-3,4-dihydropyrrol-2-yl)anilino)but-2-ynyl]anilino]-3,4-dihydropyrrol-2-one
Wiley ID 1368525