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N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]benzamide

View entire compound with spectra: 2 NMR

N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]benzamide
SpectraBase Compound ID LAVRSYDEVRV
InChI InChI=1S/C18H17N3O3S/c1-23-14-9-8-12(10-15(14)24-2)11-16-20-21-18(25-16)19-17(22)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKey XJOZMIZCKJZGIB-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 16AVy00Qsfk
Name N-[5-(3,4-Dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 355.099062590 u
Formula C18H17N3O3S
InChI InChI=1S/C18H17N3O3S/c1-23-14-9-8-12(10-15(14)24-2)11-16-20-21-18(25-16)19-17(22)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKey XJOZMIZCKJZGIB-UHFFFAOYSA-N
Molecular Weight 355.412 g/mol
SMILES N(C=1SC(CC=2C=C(OC)C(=CC2)OC)=NN1)C(=O)C1=CC=CC=C1