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3-thiazolidineacetamide, N-(2-benzothiazolyl)-5-[(2-chlorophenyl)methylene]-4-oxo-2-thioxo-, (5Z)-
SpectraBase Compound ID FdKJ3VFNNiB
InChI InChI=1S/C19H12ClN3O2S3/c20-12-6-2-1-5-11(12)9-15-17(25)23(19(26)28-15)10-16(24)22-18-21-13-7-3-4-8-14(13)27-18/h1-9H,10H2,(H,21,22,24)/b15-9-
InChIKey IHFSOWOVASNCNU-DHDCSXOGSA-N
Mol Weight 445.96 g/mol
Molecular Formula C19H12ClN3O2S3
Exact Mass 444.978018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FmaOqxKyjX9
Name 3-Thiazolidineacetamide, N-(2-benzothiazolyl)-5-[(2-chlorophenyl)methylene]-4-oxo-2-thioxo-, (5Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.978017858 u
Formula C19H12ClN3O2S3
InChI InChI=1S/C19H12ClN3O2S3/c20-12-6-2-1-5-11(12)9-15-17(25)23(19(26)28-15)10-16(24)22-18-21-13-7-3-4-8-14(13)27-18/h1-9H,10H2,(H,21,22,24)/b15-9-
InChIKey IHFSOWOVASNCNU-DHDCSXOGSA-N
Molecular Weight 445.957 g/mol
SMILES N(C1=NC=2C=CC=CC2S1)C(CN1C(S\C(C1=O)=C\C1=C(Cl)C=CC=C1)=S)=O