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N-benzyl-N-methyl-4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
SpectraBase Compound ID 4kg3GCZDxAS
InChI InChI=1S/C23H24N2O2S2/c1-17-10-12-18(13-11-17)15-20-22(27)25(23(28)29-20)14-6-9-21(26)24(2)16-19-7-4-3-5-8-19/h3-5,7-8,10-13,15H,6,9,14,16H2,1-2H3/b20-15-
InChIKey ANMGGTCFOBVNIO-HKWRFOASSA-N
Mol Weight 424.58 g/mol
Molecular Formula C23H24N2O2S2
Exact Mass 424.12792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HQWF46mR3xj
Name N-Benzyl-N-methyl-4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.127920367 u
Formula C23H24N2O2S2
InChI InChI=1S/C23H24N2O2S2/c1-17-10-12-18(13-11-17)15-20-22(27)25(23(28)29-20)14-6-9-21(26)24(2)16-19-7-4-3-5-8-19/h3-5,7-8,10-13,15H,6,9,14,16H2,1-2H3/b20-15-
InChIKey ANMGGTCFOBVNIO-HKWRFOASSA-N
Molecular Weight 424.577 g/mol
SMILES C1=CC=C(CN(C(CCCN2C(S\C(C2=O)=C\C2=CC=C(C=C2)C)=S)=O)C)C=C1