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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-5-(4-morpholinylmethyl)-1H-1,2,3-triazole-4-carbohydrazide

View entire compound with spectra: 2 NMR

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-5-(4-morpholinylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID FhKerg5pIYk
InChI InChI=1S/C24H25N9O4/c25-22-23(30-37-29-22)33-20(15-32-9-11-35-12-10-32)21(27-31-33)24(34)28-26-14-18-7-4-8-19(13-18)36-16-17-5-2-1-3-6-17/h1-8,13-14H,9-12,15-16H2,(H2,25,29)(H,28,34)/b26-14+
InChIKey CDQMJUVDIBWKJV-VULFUBBASA-N
Mol Weight 503.52 g/mol
Molecular Formula C24H25N9O4
Exact Mass 503.20295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CBB7sv2kaI5
Name 1-(4-Amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-5-(4-morpholinylmethyl)-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 503.202950317 u
Formula C24H25N9O4
InChI InChI=1S/C24H25N9O4/c25-22-23(30-37-29-22)33-20(15-32-9-11-35-12-10-32)21(27-31-33)24(34)28-26-14-18-7-4-8-19(13-18)36-16-17-5-2-1-3-6-17/h1-8,13-14H,9-12,15-16H2,(H2,25,29)(H,28,34)/b26-14+
InChIKey CDQMJUVDIBWKJV-VULFUBBASA-N
Molecular Weight 503.523 g/mol
SMILES N(\N=C\C=1C=C(OCC=2C=CC=CC2)C=CC1)C(C1=C(N(C=2C(=NON2)N)N=N1)CN1CCOCC1)=O