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3-(4-chlorophenyl)-5-((1,3-diphenyl-1H-pyrazol-4-yl)methylene-2-thioxothiazolidin-4-one)
SpectraBase Compound ID JuxthO9V88H
InChI InChI=1S/C25H16ClN3OS2/c26-19-11-13-21(14-12-19)29-24(30)22(32-25(29)31)15-18-16-28(20-9-5-2-6-10-20)27-23(18)17-7-3-1-4-8-17/h1-16H
InChIKey FGGMVDLPADSNND-UHFFFAOYSA-N
Mol Weight 474.0 g/mol
Molecular Formula C25H16ClN3OS2
Exact Mass 473.042332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3svyBGQ5wgN
Name 3-(4-chlorophenyl)-5-((1,3-diphenyl-1H-pyrazol-4-yl)methylene-2-thioxothiazolidin-4-one)
Appearance Yellow crystalline solid
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Formula C25H16ClN3OS2
InChI InChI=1S/C25H16ClN3OS2/c26-19-11-13-21(14-12-19)29-24(30)22(32-25(29)31)15-18-16-28(20-9-5-2-6-10-20)27-23(18)17-7-3-1-4-8-17/h1-16H
InChIKey FGGMVDLPADSNND-UHFFFAOYSA-N
Instrument Name Shimadzu QP2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2013.05.029
Molecular Weight 473.996 g/mol
SMILES C(c1c(n[n](c1)-c1ccccc1)-c1ccccc1)=C1C(N(C(S1)=S)c1ccc(cc1)Cl)=O
SPLASH splash10-004i-0690300000-7ee5c9fa62088139855d
Source of Spectrum AJC-10-SM12-3a
Wiley ID 1857154