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N-(3-dibenzofuranyl)-4-(dipropylsulfamoyl)benzamide
SpectraBase Compound ID 6xcKIbYECui
InChI InChI=1S/C25H26N2O4S/c1-3-15-27(16-4-2)32(29,30)20-12-9-18(10-13-20)25(28)26-19-11-14-22-21-7-5-6-8-23(21)31-24(22)17-19/h5-14,17H,3-4,15-16H2,1-2H3,(H,26,28)
InChIKey HCFIDDJQDFAIBW-UHFFFAOYSA-N
Mol Weight 450.55 g/mol
Molecular Formula C25H26N2O4S
Exact Mass 450.161328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CSu5z6jBlUL
Name N-(3-Dibenzofuranyl)-4-(dipropylsulfamoyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 450.161328495 u
Formula C25H26N2O4S
InChI InChI=1S/C25H26N2O4S/c1-3-15-27(16-4-2)32(29,30)20-12-9-18(10-13-20)25(28)26-19-11-14-22-21-7-5-6-8-23(21)31-24(22)17-19/h5-14,17H,3-4,15-16H2,1-2H3,(H,26,28)
InChIKey HCFIDDJQDFAIBW-UHFFFAOYSA-N
Molecular Weight 450.553 g/mol
SMILES CCCN(S(C=1C=CC(C(NC2=CC=3OC=4C=CC=CC4C3C=C2)=O)=CC1)(=O)=O)CCC