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4-(3,4-Diphenylthiazol-2-ylidene)-3-methyl-1-thiocarbamoyl-2-pyrazolin-5-one
SpectraBase Compound ID 4DPqRm3CaaF
InChI InChI=1S/C20H16N4OS2/c1-13-17(18(25)24(22-13)20(21)26)19-23(15-10-6-3-7-11-15)16(12-27-19)14-8-4-2-5-9-14/h2-12H,1H3,(H2,21,26)
InChIKey BJWSQWQGZGVSDN-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C20H16N4OS2
Exact Mass 392.076553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFuSm8OuWXW
Name 4-(3,4-Diphenylthiazol-2-ylidene)-3-methyl-1-thiocarbamoyl-2-pyrazolin-5-one
Appearance Yellow powder
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N4OS2
InChI InChI=1S/C20H16N4OS2/c1-13-17(18(25)24(22-13)20(21)26)19-23(15-10-6-3-7-11-15)16(12-27-19)14-8-4-2-5-9-14/h2-12H,1H3,(H2,21,26)
InChIKey BJWSQWQGZGVSDN-UHFFFAOYSA-N
Instrument Name Shimadzu Qp-2010 Plus
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2588
Molecular Weight 392.495 g/mol
SMILES NC(N1N=C(C(=C2N(C(c3ccccc3)=CS2)c2ccccc2)C1=O)C)=S
SPLASH splash10-054o-9533000000-0dcd57a4b0ba2957dc92
Source of Spectrum Y-54-339-23b
Thin-Layer Chromatography Rf = 0.28 (petroleum ether/ethyl acetate, 3:1)
Wiley ID 1877832