hexyl 2-({(E)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate

SpectraBase Compound ID	A1O5TRCNXU3
InChI	InChI=1S/C25H24FN3O2S/c1-2-3-4-7-14-31-25(30)21-8-5-6-9-22(21)28-16-19(15-27)24-29-23(17-32-24)18-10-12-20(26)13-11-18/h5-6,8-13,16-17,28H,2-4,7,14H2,1H3/b19-16+
InChIKey	XQEYRVCZUNTXGJ-KNTRCKAVSA-N Google Search
Mol Weight	449.54 g/mol
Molecular Formula	C25H24FN3O2S
Exact Mass	449.157326 g/mol

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SpectraBase Spectrum ID	A7LKWXnSuXN
Name	hexyl 2-({(E)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C25H24FN3O2S/c1-2-3-4-7-14-31-25(30)21-8-5-6-9-22(21)28-16-19(15-27)24-29-23(17-32-24)18-10-12-20(26)13-11-18/h5-6,8-13,16-17,28H,2-4,7,14H2,1H3/b19-16+
InChIKey	XQEYRVCZUNTXGJ-KNTRCKAVSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4447
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 120454; Labnumber: ULGAP-02-4404; VK_ID: VK-004448
Synonyms	hexyl 2-({2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Temperature	318 °C