butyl 4-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate

SpectraBase Compound ID	6fj4Tb3PIIW
InChI	InChI=1S/C16H20N4O3S/c1-3-4-9-23-15(22)12-5-7-13(8-6-12)18-14(21)10-24-16-19-17-11-20(16)2/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,21)
InChIKey	RALROHZUPCWIRF-UHFFFAOYSA-N Google Search
Mol Weight	348.42 g/mol
Molecular Formula	C16H20N4O3S
Exact Mass	348.125612 g/mol

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SpectraBase Spectrum ID	Fg6lTf8QH62
Name	butyl 4-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
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/C16H20N4O3S/c1-3-4-9-23-15(22)12-5-7-13(8-6-12)18-14(21)10-24-16-19-17-11-20(16)2/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,21)
InChIKey	RALROHZUPCWIRF-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3081
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: D08970; Labnumber: SPPOL-2150; SBI_ID: SBI-003083
Temperature	315 °C