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N-(3-{[(4-chloroanilino)carbothioyl]amino}phenyl)acetamide

View entire compound with spectra: 2 NMR

N-(3-{[(4-chloroanilino)carbothioyl]amino}phenyl)acetamide
SpectraBase Compound ID 97gkZHqI7o5
InChI InChI=1S/C15H14ClN3OS/c1-10(20)17-13-3-2-4-14(9-13)19-15(21)18-12-7-5-11(16)6-8-12/h2-9H,1H3,(H,17,20)(H2,18,19,21)
InChIKey HSYYYNWGRYHCCO-UHFFFAOYSA-N
Mol Weight 319.81 g/mol
Molecular Formula C15H14ClN3OS
Exact Mass 319.054611 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D312o2lWtD1
Name N-(3-{[(4-chloroanilino)carbothioyl]amino}phenyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.054610956 u
Formula C15H14ClN3OS
InChI InChI=1S/C15H14ClN3OS/c1-10(20)17-13-3-2-4-14(9-13)19-15(21)18-12-7-5-11(16)6-8-12/h2-9H,1H3,(H,17,20)(H2,18,19,21)
InChIKey HSYYYNWGRYHCCO-UHFFFAOYSA-N
Molecular Weight 319.810 g/mol
SMILES N(C(NC1=CC=C(C=C1)Cl)=S)C1=CC(NC(=O)C)=CC=C1