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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-3-furylmethylidene]-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)-3-furylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID GOzhsfIep1P
InChI InChI=1S/C17H13ClN8O3S/c18-11-1-3-12(4-2-11)30-9-13-14(17(27)22-20-7-10-5-6-28-8-10)21-25-26(13)16-15(19)23-29-24-16/h1-8H,9H2,(H2,19,23)(H,22,27)/b20-7+
InChIKey IXOKUZCXROCHEI-IFRROFPPSA-N
Mol Weight 444.86 g/mol
Molecular Formula C17H13ClN8O3S
Exact Mass 444.051985 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J2rx1M4g2Nw
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-3-furylmethylidene]-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/C17H13ClN8O3S/c18-11-1-3-12(4-2-11)30-9-13-14(17(27)22-20-7-10-5-6-28-8-10)21-25-26(13)16-15(19)23-29-24-16/h1-8H,9H2,(H2,19,23)(H,22,27)/b20-7+
InChIKey IXOKUZCXROCHEI-IFRROFPPSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13119
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: D79987; Labnumber: NIG2-0433; SBI_ID: SBI-013122
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[3-furylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C