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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID JSwMaGqff2h
InChI InChI=1S/C16H18N8O2S/c1-9(2)13-12(19-23-24(13)15-14(17)21-26-22-15)16(25)20-18-8-10-4-6-11(27-3)7-5-10/h4-9H,1-3H3,(H2,17,21)(H,20,25)/b18-8+
InChIKey XLKBAOIHLCGOSQ-QGMBQPNBSA-N
Mol Weight 386.43 g/mol
Molecular Formula C16H18N8O2S
Exact Mass 386.127343 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 51HPoln4CVH
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
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/C16H18N8O2S/c1-9(2)13-12(19-23-24(13)15-14(17)21-26-22-15)16(25)20-18-8-10-4-6-11(27-3)7-5-10/h4-9H,1-3H3,(H2,17,21)(H,20,25)/b18-8+
InChIKey XLKBAOIHLCGOSQ-QGMBQPNBSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23373
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: D37506; Labnumber: NIG1-3267; SBI_ID: SBI-023377
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C