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3-Benzyl-5-benzylidene-2-phenacylsulfanyl-imidazol-4-one
SpectraBase Compound ID 3nXGbLmsvBv
InChI InChI=1S/C25H20N2O2S/c28-23(21-14-8-3-9-15-21)18-30-25-26-22(16-19-10-4-1-5-11-19)24(29)27(25)17-20-12-6-2-7-13-20/h1-16H,17-18H2/b22-16-
InChIKey GGKFMOFDXNSDOB-JWGURIENSA-N
Mol Weight 412.51 g/mol
Molecular Formula C25H20N2O2S
Exact Mass 412.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElHT7rKLNOI
Name 3-Benzyl-5-benzylidene-2-phenacylsulfanyl-imidazol-4-one
Alternate Name(s) (Z)-1-benzyl-4-benzylidene-2-((2-oxo-2-phenylethyl)thio)-1H-imidazol-5(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20N2O2S
InChI InChI=1S/C25H20N2O2S/c28-23(21-14-8-3-9-15-21)18-30-25-26-22(16-19-10-4-1-5-11-19)24(29)27(25)17-20-12-6-2-7-13-20/h1-16H,17-18H2/b22-16-
InChIKey GGKFMOFDXNSDOB-JWGURIENSA-N
Literature Reference DOI 10.1002/hc.10160
Molecular Weight 412.507 g/mol
SMILES C1(\C(N=C(N1Cc1ccccc1)SCC(c1ccccc1)=O)=C\c1ccccc1)=O
SPLASH splash10-0a4o-9802100000-cf9154f641f79fd48850
Source of Spectrum HAC-14-351-4i
Wiley ID 1775927