2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethylphenyl)acetamide

SpectraBase Compound ID	DvhT8QjdhQ0
InChI	InChI=1S/C21H23ClN4O2S/c1-3-15-7-5-6-8-18(15)23-20(27)14-29-21-25-24-19(26(21)4-2)13-28-17-11-9-16(22)10-12-17/h5-12H,3-4,13-14H2,1-2H3,(H,23,27)
InChIKey	UPRVFYRYDSZPNW-UHFFFAOYSA-N Google Search
Mol Weight	430.95 g/mol
Molecular Formula	C21H23ClN4O2S
Exact Mass	430.123025 g/mol

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SpectraBase Spectrum ID	JlUn2FsL7JX
Name	2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethylphenyl)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/C21H23ClN4O2S/c1-3-15-7-5-6-8-18(15)23-20(27)14-29-21-25-24-19(26(21)4-2)13-28-17-11-9-16(22)10-12-17/h5-12H,3-4,13-14H2,1-2H3,(H,23,27)
InChIKey	UPRVFYRYDSZPNW-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11106
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: E05841; Labnumber: GRES-11215; SBI_ID: SBI-011109
Temperature	318 °C