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N-(3-Butoxyphenyl)-2-([3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]sulfanyl)acetamide
SpectraBase Compound ID L7RxZHMG2pS
InChI InChI=1S/C23H20F3N3O2S2/c1-2-3-9-31-16-7-4-6-15(11-16)28-21(30)14-33-22-17(13-27)18(23(24,25)26)12-19(29-22)20-8-5-10-32-20/h4-8,10-12H,2-3,9,14H2,1H3,(H,28,30)
InChIKey ZTJDDGFFWRQWEB-UHFFFAOYSA-N
Mol Weight 491.55 g/mol
Molecular Formula C23H20F3N3O2S2
Exact Mass 491.094904 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SdYyPSh0S7
Name 3'-BUTOXY-2-{[3-CYANO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)-2-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H20F3N3O2S2
InChI InChI=1S/C23H20F3N3O2S2/c1-2-3-9-31-16-7-4-6-15(11-16)28-21(30)14-33-22-17(13-27)18(23(24,25)26)12-19(29-22)20-8-5-10-32-20/h4-8,10-12H,2-3,9,14H2,1H3,(H,28,30)
InChIKey ZTJDDGFFWRQWEB-UHFFFAOYSA-N
Molecular Weight 491.0945
SMILES N(c1cccc(OCCCC)c1)C(=O)CSc1nc(-c2sccc2)cc(C(F)(F)F)c1C#N
SPLASH splash10-0a4l-9641000000-c884f9e44de248ea2896
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany