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N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenoxy)acetamide
SpectraBase Compound ID 57bPOm50cJS
InChI InChI=1S/C18H17N3O3S/c1-12-7-9-13(10-8-12)24-11-16(22)19-18-21-20-17(25-18)14-5-3-4-6-15(14)23-2/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKey DPDDBHPHPTVTJP-UHFFFAOYSA-N
Mol Weight 355.41 g/mol
Molecular Formula C18H17N3O3S
Exact Mass 355.099063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9cJ2pfJpQag
Name N-[5-(2-Methoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-(4-methylphenoxy)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 355.099062590 u
Formula C18H17N3O3S
InChI InChI=1S/C18H17N3O3S/c1-12-7-9-13(10-8-12)24-11-16(22)19-18-21-20-17(25-18)14-5-3-4-6-15(14)23-2/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKey DPDDBHPHPTVTJP-UHFFFAOYSA-N
Molecular Weight 355.412 g/mol
SMILES N(C=1SC(=NN1)C=1C(OC)=CC=CC1)C(=O)COC1=CC=C(C=C1)C