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1H-indene-3-acetamide, 5-fluoro-2-methyl-1-[[4-(methylsulfinyl)phenyl]methylene]-N-(2-thiazolyl)-, (1E)-
SpectraBase Compound ID 1Nb6VelhNnK
InChI InChI=1S/C23H19FN2O2S2/c1-14-19(11-15-3-6-17(7-4-15)30(2)28)18-8-5-16(24)12-21(18)20(14)13-22(27)26-23-25-9-10-29-23/h3-12H,13H2,1-2H3,(H,25,26,27)/b19-11+
InChIKey OWZZPDJNIRNDDL-YBFXNURJSA-N
Mol Weight 438.54 g/mol
Molecular Formula C23H19FN2O2S2
Exact Mass 438.087198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ck1NwBsXwcs
Name 1H-Indene-3-acetamide, 5-fluoro-2-methyl-1-[[4-(methylsulfinyl)phenyl]methylene]-N-(2-thiazolyl)-, (1E)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.087198369 u
Formula C23H19FN2O2S2
InChI InChI=1S/C23H19FN2O2S2/c1-14-19(11-15-3-6-17(7-4-15)30(2)28)18-8-5-16(24)12-21(18)20(14)13-22(27)26-23-25-9-10-29-23/h3-12H,13H2,1-2H3,(H,25,26,27)/b19-11+
InChIKey OWZZPDJNIRNDDL-YBFXNURJSA-N
Molecular Weight 438.535 g/mol
SMILES N(C1=NC=CS1)C(CC1=C(\C(C=2C1=CC(=CC2)F)=C/C=1C=CC(S(=O)C)=CC1)C)=O