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1-(Phenylsulfonyl)-3-(thio-1-naphthoyl)urea

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

1-(Phenylsulfonyl)-3-(thio-1-naphthoyl)urea
SpectraBase Compound ID CFfKWsxlGeb
InChI InChI=1S/C18H14N2O3S2/c21-18(20-25(22,23)14-9-2-1-3-10-14)19-17(24)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H,(H2,19,20,21,24)
InChIKey SXFBDRBWPNHBTI-UHFFFAOYSA-N
Mol Weight 370.44 g/mol
Molecular Formula C18H14N2O3S2
Exact Mass 370.044585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 99Kum0Zk5J4
Name 1-(Phenylsulfonyl)-3-(thio-1-naphthoyl)urea
Comments Computed using HOSE algorithm
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Exact Mass 370.044584664 u
Formula C18H14N2O3S2
InChI InChI=1S/C18H14N2O3S2/c21-18(20-25(22,23)14-9-2-1-3-10-14)19-17(24)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H,(H2,19,20,21,24)
InChIKey SXFBDRBWPNHBTI-UHFFFAOYSA-N
Molecular Weight 370.441 g/mol
SMILES N(S(C1=CC=CC=C1)(=O)=O)C(NC(C=1C=2C=CC=CC2C=CC1)=S)=O