2-({4-allyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide

SpectraBase Compound ID	6scoOdx2Yz3
InChI	InChI=1S/C22H24ClN5O2S/c1-3-13-28-20(14-24-17-7-5-16(23)6-8-17)26-27-22(28)31-15-21(29)25-18-9-11-19(12-10-18)30-4-2/h3,5-12,24H,1,4,13-15H2,2H3,(H,25,29)
InChIKey	DRFCIZVIAXAEBS-UHFFFAOYSA-N Google Search
Mol Weight	457.98 g/mol
Molecular Formula	C22H24ClN5O2S
Exact Mass	457.133924 g/mol

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SpectraBase Spectrum ID	CNDghTSK4KC
Name	2-({4-allyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)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/C22H24ClN5O2S/c1-3-13-28-20(14-24-17-7-5-16(23)6-8-17)26-27-22(28)31-15-21(29)25-18-9-11-19(12-10-18)30-4-2/h3,5-12,24H,1,4,13-15H2,2H3,(H,25,29)
InChIKey	DRFCIZVIAXAEBS-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_18117
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: UZI/9059245; Labnumber: STA-0011581; UZI_ID: UZI-018124
Temperature	318 °C