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

SpectraBase Compound ID	7FttpaaiEs0
InChI	InChI=1S/C25H25N3O2S/c1-2-3-4-10-15-30-25(29)21-13-8-9-14-22(21)27-17-20(16-26)24-28-23(18-31-24)19-11-6-5-7-12-19/h5-9,11-14,17-18,27H,2-4,10,15H2,1H3/b20-17+
InChIKey	DOFLLYWSVAYFHC-LVZFUZTISA-N Google Search
Mol Weight	431.55 g/mol
Molecular Formula	C25H25N3O2S
Exact Mass	431.166748 g/mol

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SpectraBase Spectrum ID	2Zjw978v0ti
Name	hexyl 2-{[(E)-2-cyano-2-(4-phenyl-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/C25H25N3O2S/c1-2-3-4-10-15-30-25(29)21-13-8-9-14-22(21)27-17-20(16-26)24-28-23(18-31-24)19-11-6-5-7-12-19/h5-9,11-14,17-18,27H,2-4,10,15H2,1H3/b20-17+
InChIKey	DOFLLYWSVAYFHC-LVZFUZTISA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4434
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: 120441; Labnumber: ULGAP-01-4404; VK_ID: VK-004435
Synonyms	hexyl 2-{[2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}benzoate
Temperature	318 °C