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Ethyl 4-({[2-(4-chlorophenyl)-1,3-thiazolidin-3-yl]carbothioyl}amino)benzoate
SpectraBase Compound ID EGNEMpVjzr7
InChI InChI=1S/C19H19ClN2O2S2/c1-2-24-18(23)14-5-9-16(10-6-14)21-19(25)22-11-12-26-17(22)13-3-7-15(20)8-4-13/h3-10,17H,2,11-12H2,1H3,(H,21,25)
InChIKey RBWUSPJCTRYZMD-UHFFFAOYSA-N
Mol Weight 406.95 g/mol
Molecular Formula C19H19ClN2O2S2
Exact Mass 406.057648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9zzU3a5bNPk
Name Ethyl 4-({[2-(4-chlorophenyl)-1,3-thiazolidin-3-yl]carbothioyl}amino)benzoate
Comments Computed using HOSE algorithm
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Exact Mass 406.057647906 u
Formula C19H19ClN2O2S2
InChI InChI=1S/C19H19ClN2O2S2/c1-2-24-18(23)14-5-9-16(10-6-14)21-19(25)22-11-12-26-17(22)13-3-7-15(20)8-4-13/h3-10,17H,2,11-12H2,1H3,(H,21,25)
InChIKey RBWUSPJCTRYZMD-UHFFFAOYSA-N
Molecular Weight 406.946 g/mol
SMILES N(C(N1C(SCC1)C=1C=CC(=CC1)Cl)=S)C=1C=CC(C(=O)OCC)=CC1