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1-(1-Naphthoyl)-3-(thio-p-toluoyl)urea

View entire compound with spectra: 2 NMR, and 1 FTIR

1-(1-Naphthoyl)-3-(thio-p-toluoyl)urea
SpectraBase Compound ID dQqgO8I9tT
InChI InChI=1S/C20H16N2O2S/c1-13-9-11-15(12-10-13)19(25)22-20(24)21-18(23)17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H2,21,22,23,24,25)
InChIKey HVZFEUVRTATNIK-UHFFFAOYSA-N
Mol Weight 348.42 g/mol
Molecular Formula C20H16N2O2S
Exact Mass 348.093249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7FnPMoAG9wS
Name 1-(1-Naphthoyl)-3-(thio-p-toluoyl)urea
Comments Computed using HOSE algorithm
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Exact Mass 348.093248935 u
Formula C20H16N2O2S
InChI InChI=1S/C20H16N2O2S/c1-13-9-11-15(12-10-13)19(25)22-20(24)21-18(23)17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H2,21,22,23,24,25)
InChIKey HVZFEUVRTATNIK-UHFFFAOYSA-N
Molecular Weight 348.420 g/mol
SMILES N(C(C1=CC=C(C=C1)C)=S)C(NC(C=1C=2C=CC=CC2C=CC1)=O)=O