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

SpectraBase Compound ID	L4zmNBr4NV
InChI	InChI=1S/C28H25N3O4S/c1-2-3-4-9-14-34-27(32)21-11-6-7-12-23(21)30-17-20(16-29)26-31-24(18-36-26)22-15-19-10-5-8-13-25(19)35-28(22)33/h5-8,10-13,15,17-18,30H,2-4,9,14H2,1H3/b20-17+
InChIKey	JCQXVPLZYCLGHU-LVZFUZTISA-N Google Search
Mol Weight	499.59 g/mol
Molecular Formula	C28H25N3O4S
Exact Mass	499.156577 g/mol

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SpectraBase Spectrum ID	LdMmYvqs4j6
Name	hexyl 2-({(E)-2-cyano-2-[4-(2-oxo-2H-chromen-3-yl)-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/C28H25N3O4S/c1-2-3-4-9-14-34-27(32)21-11-6-7-12-23(21)30-17-20(16-29)26-31-24(18-36-26)22-15-19-10-5-8-13-25(19)35-28(22)33/h5-8,10-13,15,17-18,30H,2-4,9,14H2,1H3/b20-17+
InChIKey	JCQXVPLZYCLGHU-LVZFUZTISA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4567
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: 120601; Labnumber: ULGAP-19-4404; VK_ID: VK-004568
Synonyms	hexyl 2-({2-cyano-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Temperature	318 °C