4-(1-phenylethyl)-5-{[2-(2-pyridinyl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	FXF9C5DQCcr
InChI	InChI=1S/C23H20N6S/c1-16(17-9-3-2-4-10-17)29-21(26-27-23(29)30)15-28-20-13-6-5-11-18(20)25-22(28)19-12-7-8-14-24-19/h2-14,16H,15H2,1H3,(H,27,30)
InChIKey	AMXUEKXZHPBYEJ-UHFFFAOYSA-N Google Search
Mol Weight	412.52 g/mol
Molecular Formula	C23H20N6S
Exact Mass	412.147016 g/mol

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SpectraBase Spectrum ID	92ryXA4anf9
Name	4-(1-phenylethyl)-5-{[2-(2-pyridinyl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
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/C23H20N6S/c1-16(17-9-3-2-4-10-17)29-21(26-27-23(29)30)15-28-20-13-6-5-11-18(20)25-22(28)19-12-7-8-14-24-19/h2-14,16H,15H2,1H3,(H,27,30)
InChIKey	AMXUEKXZHPBYEJ-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_35822
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: E94365; SBI_ID: SBI-035826
Synonyms	4-(1-phenylethyl)-5-{[2-(2-pyridinyl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature	308 °C