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2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide
SpectraBase Compound ID 3z2Qk5Mi02V
InChI InChI=1S/C18H18N4OS2/c1-12-8-9-15(13(2)10-12)20-16(23)11-24-18-22-21-17(25-18)19-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,19,21)(H,20,23)
InChIKey YUFNHDJLTOYPHC-UHFFFAOYSA-N
Mol Weight 370.49 g/mol
Molecular Formula C18H18N4OS2
Exact Mass 370.092204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GdmdMisz4Yr
Name 2-[(5-Anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 370.092203563 u
Formula C18H18N4OS2
InChI InChI=1S/C18H18N4OS2/c1-12-8-9-15(13(2)10-12)20-16(23)11-24-18-22-21-17(25-18)19-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,19,21)(H,20,23)
InChIKey YUFNHDJLTOYPHC-UHFFFAOYSA-N
Molecular Weight 370.489 g/mol
SMILES N(C=1SC(SCC(NC=2C(=CC(=CC2)C)C)=O)=NN1)C1=CC=CC=C1