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2-methoxy-N-[5-(3-pyridinyl)-1,3,4-thiadiazol-2-yl]benzamide
SpectraBase Compound ID LRT2ZLGEYTj
InChI InChI=1S/C15H12N4O2S/c1-21-12-7-3-2-6-11(12)13(20)17-15-19-18-14(22-15)10-5-4-8-16-9-10/h2-9H,1H3,(H,17,19,20)
InChIKey MVOKBCOQGPGIFK-UHFFFAOYSA-N
Mol Weight 312.35 g/mol
Molecular Formula C15H12N4O2S
Exact Mass 312.068097 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HTsnZkYoezr
Name 2-Methoxy-N-[5-(3-pyridinyl)-1,3,4-thiadiazol-2-yl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 312.068096814 u
Formula C15H12N4O2S
InChI InChI=1S/C15H12N4O2S/c1-21-12-7-3-2-6-11(12)13(20)17-15-19-18-14(22-15)10-5-4-8-16-9-10/h2-9H,1H3,(H,17,19,20)
InChIKey MVOKBCOQGPGIFK-UHFFFAOYSA-N
Molecular Weight 312.347 g/mol
SMILES N(C(C1=C(OC)C=CC=C1)=O)C=1SC(=NN1)C=1C=NC=CC1