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acetamide, 2-[[(4-methylphenyl)sulfonyl](phenylmethyl)amino]-N-(4-pyridinylmethyl)-
SpectraBase Compound ID 8YlUYhbb2ye
InChI InChI=1S/C22H23N3O3S/c1-18-7-9-21(10-8-18)29(27,28)25(16-20-5-3-2-4-6-20)17-22(26)24-15-19-11-13-23-14-12-19/h2-14H,15-17H2,1H3,(H,24,26)
InChIKey OOKYMMALHGVSSX-UHFFFAOYSA-N
Mol Weight 409.5 g/mol
Molecular Formula C22H23N3O3S
Exact Mass 409.146013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1pzf4YL1R78
Name Acetamide, 2-[[(4-methylphenyl)sulfonyl](phenylmethyl)amino]-N-(4-pyridinylmethyl)-
Comments Computed using HOSE algorithm
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Exact Mass 409.146012784 u
Formula C22H23N3O3S
InChI InChI=1S/C22H23N3O3S/c1-18-7-9-21(10-8-18)29(27,28)25(16-20-5-3-2-4-6-20)17-22(26)24-15-19-11-13-23-14-12-19/h2-14H,15-17H2,1H3,(H,24,26)
InChIKey OOKYMMALHGVSSX-UHFFFAOYSA-N
Molecular Weight 409.504 g/mol
SMILES N(C(CN(S(C1=CC=C(C=C1)C)(=O)=O)CC=1C=CC=CC1)=O)CC1=CC=NC=C1