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N-{5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-N'-phenylurea

View entire compound with spectra: 2 NMR

N-{5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-N'-phenylurea
SpectraBase Compound ID 209furQeVbQ
InChI InChI=1S/C16H13FN4O2S/c17-11-6-8-13(9-7-11)23-10-14-20-21-16(24-14)19-15(22)18-12-4-2-1-3-5-12/h1-9H,10H2,(H2,18,19,21,22)
InChIKey FABUAUZTPIBDTG-UHFFFAOYSA-N
Mol Weight 344.36 g/mol
Molecular Formula C16H13FN4O2S
Exact Mass 344.074325 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J6vNgioYAPi
Name N-{5-[(4-Fluorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-N'-phenylurea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.074325010 u
Formula C16H13FN4O2S
InChI InChI=1S/C16H13FN4O2S/c17-11-6-8-13(9-7-11)23-10-14-20-21-16(24-14)19-15(22)18-12-4-2-1-3-5-12/h1-9H,10H2,(H2,18,19,21,22)
InChIKey FABUAUZTPIBDTG-UHFFFAOYSA-N
Molecular Weight 344.364 g/mol
SMILES N(C=1SC(COC2=CC=C(C=C2)F)=NN1)C(NC1=CC=CC=C1)=O