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2-hydroxy-N-{(5Z)-5-[(1-methyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
SpectraBase Compound ID APr55Kt8MoY
InChI InChI=1S/C20H15N3O3S2/c1-22-11-12(13-6-2-4-8-15(13)22)10-17-19(26)23(20(27)28-17)21-18(25)14-7-3-5-9-16(14)24/h2-11,24H,1H3,(H,21,25)/b17-10-
InChIKey XGLNHBUVBCHONB-YVLHZVERSA-N
Mol Weight 409.48 g/mol
Molecular Formula C20H15N3O3S2
Exact Mass 409.055484 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J4g3EvarFT1
Name 2-Hydroxy-N-{(5Z)-5-[(1-methyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.055483700 u
Formula C20H15N3O3S2
InChI InChI=1S/C20H15N3O3S2/c1-22-11-12(13-6-2-4-8-15(13)22)10-17-19(26)23(20(27)28-17)21-18(25)14-7-3-5-9-16(14)24/h2-11,24H,1H3,(H,21,25)/b17-10-
InChIKey XGLNHBUVBCHONB-YVLHZVERSA-N
Molecular Weight 409.478 g/mol
SMILES N(N1C(\C(=C\C2=CN(C)C3=C2C=CC=C3)SC1=S)=O)C(C=1C(=CC=CC1)O)=O