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3-Dimethylamino-2-thioxo-5-[2-thioxo-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-4-ylmethylen]-thiazolidin-4-one
SpectraBase Compound ID Flhg15p03pm
InChI InChI=1S/C16H12F3N3OS4/c1-20(2)22-13(23)12(27-15(22)25)7-11-8-26-14(24)21(11)10-5-3-4-9(6-10)16(17,18)19/h3-8H,1-2H3/b12-7+
InChIKey AHYKRERUGKCVCY-KPKJPENVSA-N
Mol Weight 447.5 g/mol
Molecular Formula C16H12F3N3OS4
Exact Mass 446.981531 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID t2R0akls9G
Name 3-Dimethylamino-2-thioxo-5-[2-thioxo-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-4-ylmethylen]-thiazolidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12F3N3OS4
InChI InChI=1S/C16H12F3N3OS4/c1-20(2)22-13(23)12(27-15(22)25)7-11-8-26-14(24)21(11)10-5-3-4-9(6-10)16(17,18)19/h3-8H,1-2H3/b12-7+
InChIKey AHYKRERUGKCVCY-KPKJPENVSA-N
Literature Reference DOI 10.1002_1521-3897(200006)342_5_445
Molecular Weight 447.527 g/mol
SMILES C1(S\C(C(N1N(C)C)=O)=C/C=1N(C(SC1)=S)c1cc(ccc1)C(F)(F)F)=S
SPLASH splash10-0aou-9002100000-1e6294fa062bb1103d8a
Source of Spectrum JF-342-457-12b
Synonyms (E)-3-(dimethylamino)-2-thioxo-5-((2-thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydrothiazol-4-yl)methylene)thiazolidin-4-one
Wiley ID 1766985