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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[(E)-3-thienylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[(E)-3-thienylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 4HfhklX8nPH
InChI InChI=1S/C18H16N8O2S2/c1-11-2-4-13(5-3-11)30-10-14-15(18(27)22-20-8-12-6-7-29-9-12)21-25-26(14)17-16(19)23-28-24-17/h2-9H,10H2,1H3,(H2,19,23)(H,22,27)/b20-8+
InChIKey YSGGPCXEURVIEF-DNTJNYDQSA-N
Mol Weight 440.5 g/mol
Molecular Formula C18H16N8O2S2
Exact Mass 440.083764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9dKyN6yoCaA
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[(E)-3-thienylmethylidene]-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/C18H16N8O2S2/c1-11-2-4-13(5-3-11)30-10-14-15(18(27)22-20-8-12-6-7-29-9-12)21-25-26(14)17-16(19)23-28-24-17/h2-9H,10H2,1H3,(H2,19,23)(H,22,27)/b20-8+
InChIKey YSGGPCXEURVIEF-DNTJNYDQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13112
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: D79978; Labnumber: NIG2-0383; SBI_ID: SBI-013115
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[3-thienylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C