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

SpectraBase Compound ID	5KfZxeBq5ik
InChI	InChI=1S/C22H23ClN4OS/c1-4-13-27-21(16-9-11-17(23)12-10-16)25-26-22(27)29-14-20(28)24-19-8-6-5-7-18(19)15(2)3/h4-12,15H,1,13-14H2,2-3H3,(H,24,28)
InChIKey	YOIWBQZPMPCDHC-UHFFFAOYSA-N Google Search
Mol Weight	426.97 g/mol
Molecular Formula	C22H23ClN4OS
Exact Mass	426.12811 g/mol

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SpectraBase Spectrum ID	CepgqYPEv6h
Name	2-{[4-allyl-5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-isopropylphenyl)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/C22H23ClN4OS/c1-4-13-27-21(16-9-11-17(23)12-10-16)25-26-22(27)29-14-20(28)24-19-8-6-5-7-18(19)15(2)3/h4-12,15H,1,13-14H2,2-3H3,(H,24,28)
InChIKey	YOIWBQZPMPCDHC-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4421
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: D98982; Labnumber: GRES-29572; SBI_ID: SBI-004423
Temperature	308 °C