N-(1,3-benzodioxol-5-yl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

SpectraBase Compound ID	7eo1K6icbTg
InChI	InChI=1S/C22H17N5O3S/c28-20(24-16-8-9-18-19(11-16)30-14-29-18)13-31-22-26-25-21(15-5-4-10-23-12-15)27(22)17-6-2-1-3-7-17/h1-12H,13-14H2,(H,24,28)
InChIKey	AOPZQKZQDGEGBS-UHFFFAOYSA-N Google Search
Mol Weight	431.47 g/mol
Molecular Formula	C22H17N5O3S
Exact Mass	431.105211 g/mol

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SpectraBase Spectrum ID	Je6MT7NO0aJ
Name	N-(1,3-benzodioxol-5-yl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C22H17N5O3S/c28-20(24-16-8-9-18-19(11-16)30-14-29-18)13-31-22-26-25-21(15-5-4-10-23-12-15)27(22)17-6-2-1-3-7-17/h1-12H,13-14H2,(H,24,28)
InChIKey	AOPZQKZQDGEGBS-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_27361
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: D76284; Labnumber: MOR-8634; SBI_ID: SBI-027365
Temperature	315 °C