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(5Z)-3-benzyl-5-[2-(2,5-dichlorophenyl)-2-keto-ethylidene]-2-thioxo-thiazolidin-4-one
SpectraBase Compound ID AmUbJ1Xf69R
InChI InChI=1S/C18H11Cl2NO2S2/c19-12-6-7-14(20)13(8-12)15(22)9-16-17(23)21(18(24)25-16)10-11-4-2-1-3-5-11/h1-9H,10H2/b16-9-
InChIKey VVRUOHDYRVSRTK-SXGWCWSVSA-N
Mol Weight 408.32 g/mol
Molecular Formula C18H11Cl2NO2S2
Exact Mass 406.960826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dde7OjIdxul
Name (5Z)-3-Benzyl-5-[2-(2,5-dichlorophenyl)-2-keto-ethylidene]-2-thioxo-thiazolidin-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.960826344 u
Formula C18H11Cl2NO2S2
InChI InChI=1S/C18H11Cl2NO2S2/c19-12-6-7-14(20)13(8-12)15(22)9-16-17(23)21(18(24)25-16)10-11-4-2-1-3-5-11/h1-9H,10H2/b16-9-
InChIKey VVRUOHDYRVSRTK-SXGWCWSVSA-N
Molecular Weight 408.317 g/mol
SMILES C1(N(C(\C(S1)=C\C(C=1C(=CC=C(C1)Cl)Cl)=O)=O)CC=1C=CC=CC1)=S