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acetamide, 2-[[(4-bromophenyl)sulfonyl](phenylmethyl)amino]-N-(3,4-dimethylphenyl)-
SpectraBase Compound ID 5WTgZgvVqrw
InChI InChI=1S/C23H23BrN2O3S/c1-17-8-11-21(14-18(17)2)25-23(27)16-26(15-19-6-4-3-5-7-19)30(28,29)22-12-9-20(24)10-13-22/h3-14H,15-16H2,1-2H3,(H,25,27)
InChIKey HGPHOUUPOAZSQU-UHFFFAOYSA-N
Mol Weight 487.41 g/mol
Molecular Formula C23H23BrN2O3S
Exact Mass 486.061277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LoxpzBewY0o
Name Acetamide, 2-[[(4-bromophenyl)sulfonyl](phenylmethyl)amino]-N-(3,4-dimethylphenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 486.061276780 u
Formula C23H23BrN2O3S
InChI InChI=1S/C23H23BrN2O3S/c1-17-8-11-21(14-18(17)2)25-23(27)16-26(15-19-6-4-3-5-7-19)30(28,29)22-12-9-20(24)10-13-22/h3-14H,15-16H2,1-2H3,(H,25,27)
InChIKey HGPHOUUPOAZSQU-UHFFFAOYSA-N
Molecular Weight 487.412 g/mol
SMILES N(C(CN(S(C=1C=CC(=CC1)Br)(=O)=O)CC1=CC=CC=C1)=O)C=1C=C(C)C(=CC1)C