ethyl [({[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]acetate

SpectraBase Compound ID	ZC1sG1drxJ
InChI	InChI=1S/C17H22N4O4S/c1-4-21-16(12-8-6-7-9-13(12)24-3)19-20-17(21)26-11-14(22)18-10-15(23)25-5-2/h6-9H,4-5,10-11H2,1-3H3,(H,18,22)
InChIKey	KCZDBCGSXGPLCN-UHFFFAOYSA-N Google Search
Mol Weight	378.45 g/mol
Molecular Formula	C17H22N4O4S
Exact Mass	378.136176 g/mol

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SpectraBase Spectrum ID	3VFeQLqJI0A
Name	ethyl [({[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]acetate
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/C17H22N4O4S/c1-4-21-16(12-8-6-7-9-13(12)24-3)19-20-17(21)26-11-14(22)18-10-15(23)25-5-2/h6-9H,4-5,10-11H2,1-3H3,(H,18,22)
InChIKey	KCZDBCGSXGPLCN-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11232
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: E06515; Labnumber: GRES-23841; SBI_ID: SBI-011235
Temperature	315 °C