5-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide

SpectraBase Compound ID	8LA0IPhvZSW
InChI	InChI=1S/C21H21N3O4S/c1-4-24(5-2)21(26)19-13(3)15(11-22)20(29-19)23-18(25)9-7-14-6-8-16-17(10-14)28-12-27-16/h6-10H,4-5,12H2,1-3H3,(H,23,25)/b9-7+
InChIKey	QFISNHPCYJFVOI-VQHVLOKHSA-N Google Search
Mol Weight	411.48 g/mol
Molecular Formula	C21H21N3O4S
Exact Mass	411.125277 g/mol

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SpectraBase Spectrum ID	6Diqrz383LK
Name	5-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide
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/C21H21N3O4S/c1-4-24(5-2)21(26)19-13(3)15(11-22)20(29-19)23-18(25)9-7-14-6-8-16-17(10-14)28-12-27-16/h6-10H,4-5,12H2,1-3H3,(H,23,25)/b9-7+
InChIKey	QFISNHPCYJFVOI-VQHVLOKHSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_1844
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: UZI/8029535; UBI_ID: UBI-001845
Synonyms	5-{[3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide
Temperature	308 °C