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

SpectraBase Compound ID	6VMLO0Eiwj1
InChI	InChI=1S/C27H29N3O2S/c1-4-5-6-9-14-32-27(31)23-10-7-8-11-24(23)29-17-22(16-28)26-30-25(18-33-26)21-13-12-19(2)20(3)15-21/h7-8,10-13,15,17-18,29H,4-6,9,14H2,1-3H3/b22-17+
InChIKey	CVCLCSPNFWTFJP-OQKWZONESA-N Google Search
Mol Weight	459.61 g/mol
Molecular Formula	C27H29N3O2S
Exact Mass	459.198048 g/mol

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SpectraBase Spectrum ID	16CZfKEcOAu
Name	hexyl 2-({(E)-2-cyano-2-[4-(3,4-dimethylphenyl)-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/C27H29N3O2S/c1-4-5-6-9-14-32-27(31)23-10-7-8-11-24(23)29-17-22(16-28)26-30-25(18-33-26)21-13-12-19(2)20(3)15-21/h7-8,10-13,15,17-18,29H,4-6,9,14H2,1-3H3/b22-17+
InChIKey	CVCLCSPNFWTFJP-OQKWZONESA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4477
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: 120488; Labnumber: ULGAP-08-4404; VK_ID: VK-004478
Synonyms	hexyl 2-({2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Temperature	318 °C