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2-{[5-(4-methoxybenzyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(1-naphthyl)acetamide

View entire compound with spectra: 2 NMR

2-{[5-(4-methoxybenzyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(1-naphthyl)acetamide
SpectraBase Compound ID E8yq3y2TwJa
InChI InChI=1S/C22H19N3O3S/c1-27-17-11-9-15(10-12-17)13-21-24-25-22(28-21)29-14-20(26)23-19-8-4-6-16-5-2-3-7-18(16)19/h2-12H,13-14H2,1H3,(H,23,26)
InChIKey CKGRYPGSPVSYGC-UHFFFAOYSA-N
Mol Weight 405.47 g/mol
Molecular Formula C22H19N3O3S
Exact Mass 405.114713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BvbDmkLxjzx
Name 2-{[5-(4-Methoxybenzyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(1-naphthyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 405.114712655 u
Formula C22H19N3O3S
InChI InChI=1S/C22H19N3O3S/c1-27-17-11-9-15(10-12-17)13-21-24-25-22(28-21)29-14-20(26)23-19-8-4-6-16-5-2-3-7-18(16)19/h2-12H,13-14H2,1H3,(H,23,26)
InChIKey CKGRYPGSPVSYGC-UHFFFAOYSA-N
Molecular Weight 405.472 g/mol
SMILES N(C1=C2C(C=CC=C2)=CC=C1)C(CSC=1OC(=NN1)CC1=CC=C(C=C1)OC)=O