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

SpectraBase Compound ID	18ijZvVobf3
InChI	InChI=1S/C19H16BrClN4OS/c1-2-11-25-18(13-7-3-5-9-15(13)21)23-24-19(25)27-12-17(26)22-16-10-6-4-8-14(16)20/h2-10H,1,11-12H2,(H,22,26)
InChIKey	IOKFOEUQUVCISC-UHFFFAOYSA-N Google Search
Mol Weight	463.78 g/mol
Molecular Formula	C19H16BrClN4OS
Exact Mass	461.991673 g/mol

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SpectraBase Spectrum ID	8Wi0NCbh74l
Name	2-{[4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-bromophenyl)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/C19H16BrClN4OS/c1-2-11-25-18(13-7-3-5-9-15(13)21)23-24-19(25)27-12-17(26)22-16-10-6-4-8-14(16)20/h2-10H,1,11-12H2,(H,22,26)
InChIKey	IOKFOEUQUVCISC-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4497
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: D99045; Labnumber: GRES-30564; SBI_ID: SBI-004499
Temperature	315 °C