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

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-2-thienylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 75hULYDNc5J
InChI InChI=1S/C17H13ClN8O2S2/c18-10-3-5-11(6-4-10)30-9-13-14(17(27)22-20-8-12-2-1-7-29-12)21-25-26(13)16-15(19)23-28-24-16/h1-8H,9H2,(H2,19,23)(H,22,27)/b20-8+
InChIKey IWDGLUUSEWSZOG-DNTJNYDQSA-N
Mol Weight 460.92 g/mol
Molecular Formula C17H13ClN8O2S2
Exact Mass 460.029142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1rCLnVh1wfF
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-2-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/C17H13ClN8O2S2/c18-10-3-5-11(6-4-10)30-9-13-14(17(27)22-20-8-12-2-1-7-29-12)21-25-26(13)16-15(19)23-28-24-16/h1-8H,9H2,(H2,19,23)(H,22,27)/b20-8+
InChIKey IWDGLUUSEWSZOG-DNTJNYDQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13114
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: D79981; Labnumber: NIG2-0396; SBI_ID: SBI-013117
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[2-thienylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C