(2E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-propenenitrile

SpectraBase Compound ID	9umZDkleUqO
InChI	InChI=1S/C23H19N3O5S/c1-13(27)16-7-21-22(31-12-30-21)8-17(16)25-10-15(9-24)23-26-18(11-32-23)14-4-5-19(28-2)20(6-14)29-3/h4-8,10-11,25H,12H2,1-3H3/b15-10+
InChIKey	WEVMWUCXGLXFNN-XNTDXEJSSA-N Google Search
Mol Weight	449.48 g/mol
Molecular Formula	C23H19N3O5S
Exact Mass	449.104542 g/mol

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SpectraBase Spectrum ID	3A2esmgrkbL
Name	(2E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-[4-(3,4-dimethoxyphenyl)-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/C23H19N3O5S/c1-13(27)16-7-21-22(31-12-30-21)8-17(16)25-10-15(9-24)23-26-18(11-32-23)14-4-5-19(28-2)20(6-14)29-3/h4-8,10-11,25H,12H2,1-3H3/b15-10+
InChIKey	WEVMWUCXGLXFNN-XNTDXEJSSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4532
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: 120559; Labnumber: ULGAP-14-5374; VK_ID: VK-004533
Synonyms	3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-propenenitrile
Temperature	318 °C