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4-phenyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)butanamide

View entire compound with spectra: 2 NMR

4-phenyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)butanamide
SpectraBase Compound ID BRERvOOCTUd
InChI InChI=1S/C18H17N3OS/c22-16(13-7-10-14-8-3-1-4-9-14)19-18-21-20-17(23-18)15-11-5-2-6-12-15/h1-6,8-9,11-12H,7,10,13H2,(H,19,21,22)
InChIKey ASWGWQDQGKJMHP-UHFFFAOYSA-N
Mol Weight 323.41 g/mol
Molecular Formula C18H17N3OS
Exact Mass 323.109233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AV8cEwTYzTa
Name 4-Phenyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)butanamide
Comments Computed using HOSE algorithm
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Exact Mass 323.109233352 u
Formula C18H17N3OS
InChI InChI=1S/C18H17N3OS/c22-16(13-7-10-14-8-3-1-4-9-14)19-18-21-20-17(23-18)15-11-5-2-6-12-15/h1-6,8-9,11-12H,7,10,13H2,(H,19,21,22)
InChIKey ASWGWQDQGKJMHP-UHFFFAOYSA-N
Molecular Weight 323.414 g/mol
SMILES N(C=1SC(=NN1)C1=CC=CC=C1)C(=O)CCCC1=CC=CC=C1