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4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID KCdS2PZmUXZ
InChI InChI=1S/C15H17N7S/c1-10-8-13(18-17-10)14-19-20-15(23)22(14)16-9-11-4-6-12(7-5-11)21(2)3/h4-9H,1-3H3,(H,17,18)(H,20,23)/b16-9+
InChIKey VMIVQSLNJYZMRF-CXUHLZMHSA-N
Mol Weight 327.41 g/mol
Molecular Formula C15H17N7S
Exact Mass 327.126615 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID rgkzeY0cIN
Name 4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
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/C15H17N7S/c1-10-8-13(18-17-10)14-19-20-15(23)22(14)16-9-11-4-6-12(7-5-11)21(2)3/h4-9H,1-3H3,(H,17,18)(H,20,23)/b16-9+
InChIKey VMIVQSLNJYZMRF-CXUHLZMHSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10588
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: E00691; Labnumber: GRES-23005; SBI_ID: SBI-010591
Synonyms 4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol4-({[4-(dimethylamino)phenyl]methylidene}amino)-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C