2-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester

SpectraBase Compound ID	Djbt4p7d5lD
InChI	InChI=1S/C21H18N2O5S/c1-3-28-21(25)18-16(14-8-5-4-6-9-14)12-29-20(18)22-19(24)15-10-7-11-17(13(15)2)23(26)27/h4-12H,3H2,1-2H3,(H,22,24)
InChIKey	GKBQVLDXUKMPCX-UHFFFAOYSA-N Google Search
Mol Weight	410.44 g/mol
Molecular Formula	C21H18N2O5S
Exact Mass	410.093643 g/mol

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SpectraBase Spectrum ID	5VG9HSq8SFj
Name	3-thiophenecarboxylic acid, 2-[(2-methyl-3-nitrobenzoyl)amino]-4-phenyl-, ethyl ester
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	410.093642857 u
Formula	C21H18N2O5S
InChI	InChI=1S/C21H18N2O5S/c1-3-28-21(25)18-16(14-8-5-4-6-9-14)12-29-20(18)22-19(24)15-10-7-11-17(13(15)2)23(26)27/h4-12H,3H2,1-2H3,(H,22,24)
InChIKey	GKBQVLDXUKMPCX-UHFFFAOYSA-N
Molecular Weight	410.444 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_14010
Solvent	DMSO-d6
Source	Vendor ID: ZI/10026517; Lab Info: PNA; Lab Number: PNA-1991789