(2E)-3-(2-benzoyl-4-chloroanilino)-2-[4-(4-isobutylphenyl)-1,3-thiazol-2-yl]-2-propenenitrile

SpectraBase Compound ID	6AW70WvXKGS
InChI	InChI=1S/C29H24ClN3OS/c1-19(2)14-20-8-10-21(11-9-20)27-18-35-29(33-27)23(16-31)17-32-26-13-12-24(30)15-25(26)28(34)22-6-4-3-5-7-22/h3-13,15,17-19,32H,14H2,1-2H3/b23-17+
InChIKey	AGOUWESDRLZTEB-HAVVHWLPSA-N Google Search
Mol Weight	498.04 g/mol
Molecular Formula	C29H24ClN3OS
Exact Mass	497.132861 g/mol

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SpectraBase Spectrum ID	1whl3QljXyS
Name	(2E)-3-(2-benzoyl-4-chloroanilino)-2-[4-(4-isobutylphenyl)-1,3-thiazol-2-yl]-2-propenenitrile
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/C29H24ClN3OS/c1-19(2)14-20-8-10-21(11-9-20)27-18-35-29(33-27)23(16-31)17-32-26-13-12-24(30)15-25(26)28(34)22-6-4-3-5-7-22/h3-13,15,17-19,32H,14H2,1-2H3/b23-17+
InChIKey	AGOUWESDRLZTEB-HAVVHWLPSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4515
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: 120538; Labnumber: ULGAP-11-5286; VK_ID: VK-004516
Synonyms	3-(2-benzoyl-4-chloroanilino)-2-[4-(4-isobutylphenyl)-1,3-thiazol-2-yl]-2-propenenitrile
Temperature	318 °C