For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-methoxyphenyl acetate

View entire compound with spectra: 2 NMR

4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-methoxyphenyl acetate
SpectraBase Compound ID WYFzhcOCVI
InChI InChI=1S/C19H16N8O5S/c1-10(28)31-12-6-5-11(8-13(12)30-2)9-21-23-19(29)15-16(14-4-3-7-33-14)27(26-22-15)18-17(20)24-32-25-18/h3-9H,1-2H3,(H2,20,24)(H,23,29)/b21-9+
InChIKey OGXHDMKSSZOZAL-ZVBGSRNCSA-N
Mol Weight 468.45 g/mol
Molecular Formula C19H16N8O5S
Exact Mass 468.096437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1dCiasdii0r
Name 4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-methoxyphenyl acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.096436816 u
Formula C19H16N8O5S
InChI InChI=1S/C19H16N8O5S/c1-10(28)31-12-6-5-11(8-13(12)30-2)9-21-23-19(29)15-16(14-4-3-7-33-14)27(26-22-15)18-17(20)24-32-25-18/h3-9H,1-2H3,(H2,20,24)(H,23,29)/b21-9+
InChIKey OGXHDMKSSZOZAL-ZVBGSRNCSA-N
Molecular Weight 468.448 g/mol
SMILES N(\N=C\C=1C=C(OC)C(=CC1)OC(=O)C)C(C1=C(N(C=2C(=NON2)N)N=N1)C=1SC=CC1)=O