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N-(2-methoxyphenyl)-N'-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]urea
SpectraBase Compound ID 1SWoSk5ggVh
InChI InChI=1S/C17H16N4O2S/c1-11-7-3-4-8-12(11)15-20-21-17(24-15)19-16(22)18-13-9-5-6-10-14(13)23-2/h3-10H,1-2H3,(H2,18,19,21,22)
InChIKey RBAJSXAGCKPPAX-UHFFFAOYSA-N
Mol Weight 340.4 g/mol
Molecular Formula C17H16N4O2S
Exact Mass 340.099397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HMfq2QLBm0z
Name N-(2-Methoxyphenyl)-N'-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]urea
Comments Computed using HOSE algorithm
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Exact Mass 340.099396943 u
Formula C17H16N4O2S
InChI InChI=1S/C17H16N4O2S/c1-11-7-3-4-8-12(11)15-20-21-17(24-15)19-16(22)18-13-9-5-6-10-14(13)23-2/h3-10H,1-2H3,(H2,18,19,21,22)
InChIKey RBAJSXAGCKPPAX-UHFFFAOYSA-N
Molecular Weight 340.401 g/mol
SMILES N(C=1SC(=NN1)C=1C(C)=CC=CC1)C(NC=1C(OC)=CC=CC1)=O