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4(5H)-thiazolone, 5-[(4-methoxyphenyl)methylene]-2-[4-[1-oxo-3-[(5E)-4-oxo-5-(2-thienylmethylene)-2-thioxothiazolidinyl]propyl]-1-piperazinyl]-, (5Z)-

View entire compound with spectra: 2 NMR

4(5H)-thiazolone, 5-[(4-methoxyphenyl)methylene]-2-[4-[1-oxo-3-[(5E)-4-oxo-5-(2-thienylmethylene)-2-thioxothiazolidinyl]propyl]-1-piperazinyl]-, (5Z)-
SpectraBase Compound ID 1VEKMYbCHfb
InChI InChI=1S/C26H24N4O4S4/c1-34-18-6-4-17(5-7-18)15-20-23(32)27-25(37-20)29-12-10-28(11-13-29)22(31)8-9-30-24(33)21(38-26(30)35)16-19-3-2-14-36-19/h2-7,14-16H,8-13H2,1H3/b20-15-,21-16+
InChIKey UCEUHPSCNWAADK-MEDLQYOTSA-N
Mol Weight 584.7 g/mol
Molecular Formula C26H24N4O4S4
Exact Mass 584.06804 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fieagar3r2Z
Name 4(5H)-Thiazolone, 5-[(4-methoxyphenyl)methylene]-2-[4-[1-oxo-3-[(5E)-4-oxo-5-(2-thienylmethylene)-2-thioxothiazolidinyl]propyl]-1-piperazinyl]-, (5Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 584.068039961 u
Formula C26H24N4O4S4
InChI InChI=1S/C26H24N4O4S4/c1-34-18-6-4-17(5-7-18)15-20-23(32)27-25(37-20)29-12-10-28(11-13-29)22(31)8-9-30-24(33)21(38-26(30)35)16-19-3-2-14-36-19/h2-7,14-16H,8-13H2,1H3/b20-15-,21-16+
InChIKey UCEUHPSCNWAADK-MEDLQYOTSA-N
Molecular Weight 584.742 g/mol
SMILES COC=1C=CC(\C=C\2SC(=NC2=O)N2CCN(C(CCN3C(S\C(C3=O)=C/C=3SC=CC3)=S)=O)CC2)=CC1