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(5Z)-5-(2-chlorobenzylidene)-3-[4-(4-methyl-1-piperazinyl)-4-oxobutyl]-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID 6xRywUV6RZi
InChI InChI=1S/C19H22ClN3O2S2/c1-21-9-11-22(12-10-21)17(24)7-4-8-23-18(25)16(27-19(23)26)13-14-5-2-3-6-15(14)20/h2-3,5-6,13H,4,7-12H2,1H3/b16-13-
InChIKey SGIJNRZPCWUKBV-SSZFMOIBSA-N
Mol Weight 423.98 g/mol
Molecular Formula C19H22ClN3O2S2
Exact Mass 423.084197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8zEuldFNUWF
Name (5Z)-5-(2-Chlorobenzylidene)-3-[4-(4-methyl-1-piperazinyl)-4-oxobutyl]-2-thioxo-1,3-thiazolidin-4-one
Comments Computed using HOSE algorithm
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Exact Mass 423.084197006 u
Formula C19H22ClN3O2S2
InChI InChI=1S/C19H22ClN3O2S2/c1-21-9-11-22(12-10-21)17(24)7-4-8-23-18(25)16(27-19(23)26)13-14-5-2-3-6-15(14)20/h2-3,5-6,13H,4,7-12H2,1H3/b16-13-
InChIKey SGIJNRZPCWUKBV-SSZFMOIBSA-N
Molecular Weight 423.977 g/mol
SMILES C1=CC=C(\C=C\2C(N(C(S2)=S)CCCC(N2CCN(CC2)C)=O)=O)C(Cl)=C1