2-[[1-oxo-2-[(1-phenyl-2-benzimidazolyl)thio]ethyl]amino]benzoic acid methyl ester

SpectraBase Compound ID	GtdMNrEriDT
InChI	InChI=1S/C23H19N3O3S/c1-29-22(28)17-11-5-6-12-18(17)24-21(27)15-30-23-25-19-13-7-8-14-20(19)26(23)16-9-3-2-4-10-16/h2-14H,15H2,1H3,(H,24,27)
InChIKey	HRPAHCVMNPFTDF-UHFFFAOYSA-N Google Search
Mol Weight	417.48 g/mol
Molecular Formula	C23H19N3O3S
Exact Mass	417.114713 g/mol

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SpectraBase Spectrum ID	HCGcy6liV48
Name	benzoic acid, 2-[[[(1-phenyl-1H-benzimidazol-2-yl)thio]acetyl]amino]-,methyl 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	417.114712655 u
Formula	C23H19N3O3S
InChI	InChI=1S/C23H19N3O3S/c1-29-22(28)17-11-5-6-12-18(17)24-21(27)15-30-23-25-19-13-7-8-14-20(19)26(23)16-9-3-2-4-10-16/h2-14H,15H2,1H3,(H,24,27)
InChIKey	HRPAHCVMNPFTDF-UHFFFAOYSA-N
Molecular Weight	417.483 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_10604
Solvent	DMSO-d6
Source	Vendor ID: NMR/10251955; Lab Info: LP; Lab Number: LP-2100746