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3-(4-chlorophenyl)-5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene-2-thioxothiazolidin-4-one)
SpectraBase Compound ID IkJQUMxvVX8
InChI InChI=1S/C25H15Cl2N3OS2/c26-18-8-6-16(7-9-18)23-17(15-29(28-23)20-4-2-1-3-5-20)14-22-24(31)30(25(32)33-22)21-12-10-19(27)11-13-21/h1-15H
InChIKey WNYAGBOHVVTGLO-UHFFFAOYSA-N
Mol Weight 508.44 g/mol
Molecular Formula C25H15Cl2N3OS2
Exact Mass 507.00336 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7450YRw2q1N
Name 3-(4-chlorophenyl)-5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene-2-thioxothiazolidin-4-one)
Appearance Yellow crystalline solid
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Formula C25H15Cl2N3OS2
InChI InChI=1S/C25H15Cl2N3OS2/c26-18-8-6-16(7-9-18)23-17(15-29(28-23)20-4-2-1-3-5-20)14-22-24(31)30(25(32)33-22)21-12-10-19(27)11-13-21/h1-15H
InChIKey WNYAGBOHVVTGLO-UHFFFAOYSA-N
Instrument Name Shimadzu QP2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2013.05.029
Molecular Weight 508.441 g/mol
SMILES C(c1c(n[n](c1)-c1ccccc1)-c1ccc(cc1)Cl)=C1C(N(C(S1)=S)c1ccc(cc1)Cl)=O
SPLASH splash10-03di-0679030000-4e441e397eef426873a6
Source of Spectrum AJC-10-SM18-3g
Wiley ID 1857160