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N-(4-ethylphenyl)-2-(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetamide

View entire compound with spectra: 2 NMR

N-(4-ethylphenyl)-2-(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetamide
SpectraBase Compound ID IGl9FgcylWb
InChI InChI=1S/C16H16N4OS/c1-2-11-5-7-12(8-6-11)18-14(21)10-22-16-19-13-4-3-9-17-15(13)20-16/h3-9H,2,10H2,1H3,(H,18,21)(H,17,19,20)
InChIKey OSDLJTPGLJFULH-UHFFFAOYSA-N
Mol Weight 312.39 g/mol
Molecular Formula C16H16N4OS
Exact Mass 312.104482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4MgXh8HX1Oi
Name N-(4-Ethylphenyl)-2-(3H-imidazo[4,5-B]pyridin-2-ylsulfanyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 312.104482324 u
Formula C16H16N4OS
InChI InChI=1S/C16H16N4OS/c1-2-11-5-7-12(8-6-11)18-14(21)10-22-16-19-13-4-3-9-17-15(13)20-16/h3-9H,2,10H2,1H3,(H,18,21)(H,17,19,20)
InChIKey OSDLJTPGLJFULH-UHFFFAOYSA-N
Molecular Weight 312.391 g/mol
SMILES N(C(CSC=1NC2=C(N1)C=CC=N2)=O)C=1C=CC(=CC1)CC