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(E)-2-[2-cyano-2-(4-oxo-3-phenylthiazolidin-2-ylidene)-acetylamino]5,6-dimethyl-4-(furan-2yl)pyridine-2-yl-3-carbonitrile
SpectraBase Compound ID GIejUWNBzcz
InChI InChI=1S/C24H17N5O3S/c1-14-15(2)27-22(17(11-25)21(14)19-9-6-10-32-19)28-23(31)18(12-26)24-29(20(30)13-33-24)16-7-4-3-5-8-16/h3-10H,13H2,1-2H3,(H,27,28,31)/b24-18+
InChIKey LJJAUANXZUEHTF-HKOYGPOVSA-N
Mol Weight 455.49 g/mol
Molecular Formula C24H17N5O3S
Exact Mass 455.105211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p8RmfuejAR
Name (E)-2-[2-cyano-2-(4-oxo-3-phenylthiazolidin-2-ylidene)-acetylamino]5,6-dimethyl-4-(furan-2yl)pyridine-2-yl-3-carbonitrile
Appearance Black crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17N5O3S
InChI InChI=1S/C24H17N5O3S/c1-14-15(2)27-22(17(11-25)21(14)19-9-6-10-32-19)28-23(31)18(12-26)24-29(20(30)13-33-24)16-7-4-3-5-8-16/h3-10H,13H2,1-2H3,(H,27,28,31)/b24-18+
InChIKey LJJAUANXZUEHTF-HKOYGPOVSA-N
Instrument Name Kratos MS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2414
Molecular Weight 455.492 g/mol
SMILES N(c1c(c(c(c(n1)C)C)-c1ccco1)C#N)C(\C(C#N)=C\1SCC(N1c1ccccc1)=O)=O
SPLASH splash10-03di-9550000000-81dffc7ac26ce315a57b
Source of Spectrum Y-53-1248-17
Wiley ID 1876533