2-[(3,4-Dichlorophenyl)carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester

SpectraBase Compound ID	6yoNjmSNVIu
InChI	InChI=1S/C17H16Cl2N2O3S/c1-24-16(22)14-10-4-2-3-5-13(10)25-15(14)21-17(23)20-9-6-7-11(18)12(19)8-9/h6-8H,2-5H2,1H3,(H2,20,21,23)
InChIKey	QIDKETOIHQJRKY-UHFFFAOYSA-N Google Search
Mol Weight	399.29 g/mol
Molecular Formula	C17H16Cl2N2O3S
Exact Mass	398.025869 g/mol

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SpectraBase Spectrum ID	2e3BOTICKtw
Name	benzo[b]thiophene-3-carboxylic acid, 2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester
Copyright	Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	398.025868954 u
Formula	C17H16Cl2N2O3S
InChI	InChI=1S/C17H16Cl2N2O3S/c1-24-16(22)14-10-4-2-3-5-13(10)25-15(14)21-17(23)20-9-6-7-11(18)12(19)8-9/h6-8H,2-5H2,1H3,(H2,20,21,23)
InChIKey	QIDKETOIHQJRKY-UHFFFAOYSA-N
Molecular Weight	399.292 g/mol
NMR Offset	17.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_5334
Solvent	DMSO-d6
Source	Vendor ID: NMR/9290908; Lab Info: AU; Lab Number: AU-EC00884