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benzamide, N-(4-bromophenyl)-4-[(2-thienylsulfonyl)amino]-
SpectraBase Compound ID JxVO9AtQTca
InChI InChI=1S/C17H13BrN2O3S2/c18-13-5-9-14(10-6-13)19-17(21)12-3-7-15(8-4-12)20-25(22,23)16-2-1-11-24-16/h1-11,20H,(H,19,21)
InChIKey AUZOLYHKXHDMIM-UHFFFAOYSA-N
Mol Weight 437.33 g/mol
Molecular Formula C17H13BrN2O3S2
Exact Mass 435.955098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ENWkVTK5pK6
Name Benzamide, N-(4-bromophenyl)-4-[(2-thienylsulfonyl)amino]-
Comments Computed using HOSE algorithm
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Exact Mass 435.955097632 u
Formula C17H13BrN2O3S2
InChI InChI=1S/C17H13BrN2O3S2/c18-13-5-9-14(10-6-13)19-17(21)12-3-7-15(8-4-12)20-25(22,23)16-2-1-11-24-16/h1-11,20H,(H,19,21)
InChIKey AUZOLYHKXHDMIM-UHFFFAOYSA-N
Molecular Weight 437.326 g/mol
SMILES N(C(C=1C=CC(NS(C=2SC=CC2)(=O)=O)=CC1)=O)C1=CC=C(C=C1)Br