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N-Butyl-4-{2-[5-(4-methylbenzylidene)-2,4-dioxothiazolidin-3-yl]acetamido}benzamide
SpectraBase Compound ID 7DZtbgddqWZ
InChI InChI=1S/C24H25N3O4S/c1-3-4-13-25-22(29)18-9-11-19(12-10-18)26-21(28)15-27-23(30)20(32-24(27)31)14-17-7-5-16(2)6-8-17/h5-12,14H,3-4,13,15H2,1-2H3,(H,25,29)(H,26,28)
InChIKey FGNDWVHTAVMMRD-UHFFFAOYSA-N
Mol Weight 451.54 g/mol
Molecular Formula C24H25N3O4S
Exact Mass 451.156577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFK9Tp9setZ
Name N-Butyl-4-{2-[5-(4-methylbenzylidene)-2,4-dioxothiazolidin-3-yl]acetamido}benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25N3O4S
InChI InChI=1S/C24H25N3O4S/c1-3-4-13-25-22(29)18-9-11-19(12-10-18)26-21(28)15-27-23(30)20(32-24(27)31)14-17-7-5-16(2)6-8-17/h5-12,14H,3-4,13,15H2,1-2H3,(H,25,29)(H,26,28)
InChIKey FGNDWVHTAVMMRD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202300137
Molecular Weight 451.541 g/mol
Quality 81
SMILES N(CCCC)C(C1=CC=C(C=C1)NC(CN1C(SC(C1=O)=CC1=CC=C(C=C1)C)=O)=O)=O
SPLASH splash10-0006-9000100000-eaf82223b95fe17fbe79
Source of Spectrum APC-356-17-6a (DOI: 10.1002/ardp.202300137)
Wiley ID 1909826