2-[(2-chloro-5-nitrobenzyl)sulfanyl]-5,6-dimethyl-1H-benzimidazole

SpectraBase Compound ID	JTgou0TeAfb
InChI	InChI=1S/C16H14ClN3O2S/c1-9-5-14-15(6-10(9)2)19-16(18-14)23-8-11-7-12(20(21)22)3-4-13(11)17/h3-7H,8H2,1-2H3,(H,18,19)
InChIKey	TUELDSNEKPJXJM-UHFFFAOYSA-N Google Search
Mol Weight	347.82 g/mol
Molecular Formula	C16H14ClN3O2S
Exact Mass	347.049526 g/mol

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SpectraBase Spectrum ID	AKFkiWpfJMY
Name	2-[(2-chloro-5-nitrobenzyl)sulfanyl]-5,6-dimethyl-1H-benzimidazole
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/C16H14ClN3O2S/c1-9-5-14-15(6-10(9)2)19-16(18-14)23-8-11-7-12(20(21)22)3-4-13(11)17/h3-7H,8H2,1-2H3,(H,18,19)
InChIKey	TUELDSNEKPJXJM-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6614
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: NMR/11261480; Labnumber: LP-2111140; IOH_ID: IOH-006615
Synonyms	2-chloro-5-nitrobenzyl 5,6-dimethyl-1H-benzimidazol-2-yl sulfide