4-{[(E)-9-anthrylmethylidene]amino}-5-[4-(dimethylamino)phenyl]-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	HzFD5vI9sR3
InChI	InChI=1S/C25H21N5S/c1-29(2)20-13-11-17(12-14-20)24-27-28-25(31)30(24)26-16-23-21-9-5-3-7-18(21)15-19-8-4-6-10-22(19)23/h3-16H,1-2H3,(H,28,31)/b26-16+
InChIKey	GWKQAFMPKNXEIM-WGOQTCKBSA-N Google Search
Mol Weight	423.54 g/mol
Molecular Formula	C25H21N5S
Exact Mass	423.151767 g/mol

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SpectraBase Spectrum ID	JPs1N8n5Ikh
Name	4-{[(E)-9-anthrylmethylidene]amino}-5-[4-(dimethylamino)phenyl]-4H-1,2,4-triazole-3-thiol
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/C25H21N5S/c1-29(2)20-13-11-17(12-14-20)24-27-28-25(31)30(24)26-16-23-21-9-5-3-7-18(21)15-19-8-4-6-10-22(19)23/h3-16H,1-2H3,(H,28,31)/b26-16+
InChIKey	GWKQAFMPKNXEIM-WGOQTCKBSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16935
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: D25290; Labnumber: GRES-03350; SBI_ID: SBI-016938
Synonyms	4-{[(E)-9-anthrylmethylidene]amino}-5-[4-(dimethylamino)phenyl]-4H-1,2,4-triazol-3-yl hydrosulfide4-{[9-anthrylmethylidene]amino}-5-[4-(dimethylamino)phenyl]-4H-1,2,4-triazole-3-thiol
Temperature	315 °C