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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(5-methyl-2-thienyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

View entire compound with spectra: 2 NMR

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(5-methyl-2-thienyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID JQ7WlOT24Hn
InChI InChI=1S/C18H16N8O2S/c1-10-3-6-12(7-4-10)15-14(21-25-26(15)17-16(19)23-28-24-17)18(27)22-20-9-13-8-5-11(2)29-13/h3-9H,1-2H3,(H2,19,23)(H,22,27)/b20-9+
InChIKey YAPWOADTBLKXIX-AWQFTUOYSA-N
Mol Weight 408.44 g/mol
Molecular Formula C18H16N8O2S
Exact Mass 408.111693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GemVaZsWCi4
Name 1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-N'-[(E)-(5-methyl-2-thienyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.111692959 u
Formula C18H16N8O2S
InChI InChI=1S/C18H16N8O2S/c1-10-3-6-12(7-4-10)15-14(21-25-26(15)17-16(19)23-28-24-17)18(27)22-20-9-13-8-5-11(2)29-13/h3-9H,1-2H3,(H2,19,23)(H,22,27)/b20-9+
InChIKey YAPWOADTBLKXIX-AWQFTUOYSA-N
Molecular Weight 408.440 g/mol
SMILES N(\N=C\C=1SC(C)=CC1)C(C=1N=NN(C=2C(=NON2)N)C1C1=CC=C(C=C1)C)=O