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4-bromo-N-{(5Z)-5-[(2E)-3-(2-furyl)-2-propenylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
SpectraBase Compound ID 1gthw7Cc4Ws
InChI InChI=1S/C17H11BrN2O3S2/c18-12-8-6-11(7-9-12)15(21)19-20-16(22)14(25-17(20)24)5-1-3-13-4-2-10-23-13/h1-10H,(H,19,21)/b3-1+,14-5-
InChIKey OKMQCLWZXYOPCX-NQDFZQDQSA-N
Mol Weight 435.31 g/mol
Molecular Formula C17H11BrN2O3S2
Exact Mass 433.939448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Mun64GJ7za
Name 4-Bromo-N-{(5Z)-5-[(2E)-3-(2-furyl)-2-propenylidene]-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 433.939447567 u
Formula C17H11BrN2O3S2
InChI InChI=1S/C17H11BrN2O3S2/c18-12-8-6-11(7-9-12)15(21)19-20-16(22)14(25-17(20)24)5-1-3-13-4-2-10-23-13/h1-10H,(H,19,21)/b3-1+,14-5-
InChIKey OKMQCLWZXYOPCX-NQDFZQDQSA-N
Molecular Weight 435.310 g/mol
SMILES N(N1C(S\C(C1=O)=C\C=C\C=1OC=CC1)=S)C(C=1C=CC(=CC1)Br)=O