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

View entire compound with spectra: 2 NMR

3,4,5-trimethoxy-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide
SpectraBase Compound ID Qb0irMas74
InChI InChI=1S/C19H19N3O5S/c1-24-13-7-5-11(6-8-13)18-21-22-19(28-18)20-17(23)12-9-14(25-2)16(27-4)15(10-12)26-3/h5-10H,1-4H3,(H,20,22,23)
InChIKey MZGHVETXBUQKBB-UHFFFAOYSA-N
Mol Weight 401.44 g/mol
Molecular Formula C19H19N3O5S
Exact Mass 401.104542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID vroHiAuJH6
Name 3,4,5-Trimethoxy-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.104541893 u
Formula C19H19N3O5S
InChI InChI=1S/C19H19N3O5S/c1-24-13-7-5-11(6-8-13)18-21-22-19(28-18)20-17(23)12-9-14(25-2)16(27-4)15(10-12)26-3/h5-10H,1-4H3,(H,20,22,23)
InChIKey MZGHVETXBUQKBB-UHFFFAOYSA-N
Molecular Weight 401.437 g/mol
SMILES N(C=1SC(=NN1)C=1C=CC(=CC1)OC)C(C1=CC(OC)=C(C(=C1)OC)OC)=O