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1-Benzoyl-3-(4-chloro-2,5-dimethoxyphenyl)-2-thiourea

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

1-Benzoyl-3-(4-chloro-2,5-dimethoxyphenyl)-2-thiourea
SpectraBase Compound ID 5YntFmtlHck
InChI InChI=1S/C16H15ClN2O3S/c1-21-13-9-12(14(22-2)8-11(13)17)18-16(23)19-15(20)10-6-4-3-5-7-10/h3-9H,1-2H3,(H2,18,19,20,23)
InChIKey HQGMTFSJIINCQF-UHFFFAOYSA-N
Mol Weight 350.82 g/mol
Molecular Formula C16H15ClN2O3S
Exact Mass 350.049191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AG82f0sgt6L
Name 1-Benzoyl-3-(4-chloro-2,5-dimethoxyphenyl)-2-thiourea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.049191222 u
Formula C16H15ClN2O3S
InChI InChI=1S/C16H15ClN2O3S/c1-21-13-9-12(14(22-2)8-11(13)17)18-16(23)19-15(20)10-6-4-3-5-7-10/h3-9H,1-2H3,(H2,18,19,20,23)
InChIKey HQGMTFSJIINCQF-UHFFFAOYSA-N
Molecular Weight 350.820 g/mol
SMILES N(C1=C(C=C(C(=C1)OC)Cl)OC)C(NC(C=1C=CC=CC1)=O)=S