N-[4-(aminosulfonyl)phenyl]-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

SpectraBase Compound ID	1bPN2AM6wiJ
InChI	InChI=1S/C21H25N5O3S2/c1-21(2,3)15-7-5-14(6-8-15)19-24-25-20(26(19)4)30-13-18(27)23-16-9-11-17(12-10-16)31(22,28)29/h5-12H,13H2,1-4H3,(H,23,27)(H2,22,28,29)
InChIKey	UALCNUFUFFDAEV-UHFFFAOYSA-N Google Search
Mol Weight	459.58 g/mol
Molecular Formula	C21H25N5O3S2
Exact Mass	459.139882 g/mol

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SpectraBase Spectrum ID	GXNNJqRpDtl
Name	N-[4-(aminosulfonyl)phenyl]-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}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/C21H25N5O3S2/c1-21(2,3)15-7-5-14(6-8-15)19-24-25-20(26(19)4)30-13-18(27)23-16-9-11-17(12-10-16)31(22,28)29/h5-12H,13H2,1-4H3,(H,23,27)(H2,22,28,29)
InChIKey	UALCNUFUFFDAEV-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4353
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: D98867; Labnumber: GRES-27552; SBI_ID: SBI-004355
Temperature	306 °C