(2E)-3-(2-bromo-4-methylanilino)-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-propenenitrile

SpectraBase Compound ID	6oFYYxXGk2v
InChI	InChI=1S/C21H18BrN3S/c1-13-4-6-17(15(3)8-13)20-12-26-21(25-20)16(10-23)11-24-19-7-5-14(2)9-18(19)22/h4-9,11-12,24H,1-3H3/b16-11+
InChIKey	HRVQROLONALTFW-LFIBNONCSA-N Google Search
Mol Weight	424.36 g/mol
Molecular Formula	C21H18BrN3S
Exact Mass	423.040482 g/mol

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SpectraBase Spectrum ID	1DONGDHEPDO
Name	(2E)-3-(2-bromo-4-methylanilino)-2-[4-(2,4-dimethylphenyl)-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/C21H18BrN3S/c1-13-4-6-17(15(3)8-13)20-12-26-21(25-20)16(10-23)11-24-19-7-5-14(2)9-18(19)22/h4-9,11-12,24H,1-3H3/b16-11+
InChIKey	HRVQROLONALTFW-LFIBNONCSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4751
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: 121534; Labnumber: ULGAP-07-3998; VK_ID: VK-004752
Synonyms	3-(2-bromo-4-methylanilino)-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-propenenitrile
Temperature	315 °C