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(2E)-3-(4-bromophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-propenamide

View entire compound with spectra: 2 NMR

(2E)-3-(4-bromophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-propenamide
SpectraBase Compound ID HtuEJcuslY
InChI InChI=1S/C13H12BrN3OS/c1-2-12-16-17-13(19-12)15-11(18)8-5-9-3-6-10(14)7-4-9/h3-8H,2H2,1H3,(H,15,17,18)/b8-5+
InChIKey AWGWVDANIWUYFQ-VMPITWQZSA-N
Mol Weight 338.22 g/mol
Molecular Formula C13H12BrN3OS
Exact Mass 336.988446 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95SYQOSZfBZ
Name (2E)-3-(4-Bromophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-propenamide
Comments Computed using HOSE algorithm
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Exact Mass 336.988446191 u
Formula C13H12BrN3OS
InChI InChI=1S/C13H12BrN3OS/c1-2-12-16-17-13(19-12)15-11(18)8-5-9-3-6-10(14)7-4-9/h3-8H,2H2,1H3,(H,15,17,18)/b8-5+
InChIKey AWGWVDANIWUYFQ-VMPITWQZSA-N
Molecular Weight 338.223 g/mol
SMILES N(C=1SC(CC)=NN1)C(\C=C\C1=CC=C(Br)C=C1)=O