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Methyl 3-([(E)-anilino(phenylimino)methyl]sulfanyl)-2-oxo-3-phenylpropanoate
SpectraBase Compound ID Iu0GUqQCp6x
InChI InChI=1S/C23H20N2O3S/c1-28-22(27)20(26)21(17-11-5-2-6-12-17)29-23(24-18-13-7-3-8-14-18)25-19-15-9-4-10-16-19/h2-16,21H,1H3,(H,24,25)
InChIKey YOVXXBXAXPEEFD-UHFFFAOYSA-N
Mol Weight 404.48 g/mol
Molecular Formula C23H20N2O3S
Exact Mass 404.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6t0ydeyOCXl
Name Methyl 3-([(E)-anilino(phenylimino)methyl]sulfanyl)-2-oxo-3-phenylpropanoate
Alternate Name(s) 3-[(N,N'-diphenylamidino)thio]-2-keto-3-phenyl-propionic acid methyl ester 3-[[anilino(phenylimino)methyl]thio]-2-oxo-3-phenylpropanoic acid methyl ester Methyl 3-(N,N'-diphenylamidinothio)-3-phenylpyruvate Methyl 3-(N,N'-diphenylcarbamimidoyl)sulfanyl-2-oxidanylidene-3-phenyl-propanoate Methyl 3-(N,N'-diphenylcarbamimidoyl)sulfanyl-2-oxo-3-phenyl-propanoate
CAS Registry Number 312517-68-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20N2O3S
InChI InChI=1S/C23H20N2O3S/c1-28-22(27)20(26)21(17-11-5-2-6-12-17)29-23(24-18-13-7-3-8-14-18)25-19-15-9-4-10-16-19/h2-16,21H,1H3,(H,24,25)
InChIKey YOVXXBXAXPEEFD-UHFFFAOYSA-N
Molecular Weight 404.484 g/mol
SMILES N(\C(SC(c1ccccc1)C(=O)C(=O)OC)=N/c1ccccc1)c1ccccc1
SPLASH splash10-0fb9-9300000000-f8440ebbb5940b9ba244
Wiley ID 1470478