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4-thiazolidinone, 3-ethyl-2-[(Z)-ethylimino]-5-[[3-(4-fluorophenyl)-1-(1-oxopropyl)-1H-pyrazol-4-yl]methylene]-, (2Z,5Z)-
SpectraBase Compound ID 3QE0CQ49qgN
InChI InChI=1S/C20H21FN4O2S/c1-4-17(26)25-12-14(18(23-25)13-7-9-15(21)10-8-13)11-16-19(27)24(6-3)20(28-16)22-5-2/h7-12H,4-6H2,1-3H3/b16-11-,22-20-
InChIKey USOOYURVMDWAKE-OXRKSLHJSA-N
Mol Weight 400.47 g/mol
Molecular Formula C20H21FN4O2S
Exact Mass 400.136925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9m9dOBT0O8A
Name 3-Ethyl-2-ethylimino-5-[3-(4-fluoro-phenyl)-1-propionyl-1H-pyrazol-4-ylmethylene]-thiazolidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21FN4O2S
InChI InChI=1S/C20H21FN4O2S/c1-4-17(26)25-12-14(18(23-25)13-7-9-15(21)10-8-13)11-16-19(27)24(6-3)20(28-16)22-5-2/h7-12H,4-6H2,1-3H3/b16-11-,22-20-
InChIKey USOOYURVMDWAKE-OXRKSLHJSA-N
Molecular Weight 400.472 g/mol
SMILES CC\N=C\1N(C(\C(=C\c2c(n[n](c2)C(=O)CC)-c2ccc(cc2)F)S1)=O)CC
SPLASH splash10-014i-3896400000-3fa6768ceed2afa06ad6
Synonyms (2Z,5Z)-3-ethyl-2-[(Z)-ethylimino]-5-{[3-(4-fluorophenyl)-1-propionyl-1H-pyrazol-4-yl]methylene}-1,3-thiazolidin-4-one 3-Ethyl-2-[ethylimino]-5-{[3-(4-fluorophenyl)-1-propionyl-1H-pyrazol-4-yl]methylene}-1,3-thiazolidin-4-one
Wiley ID 1462730