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N-{2-[4-(aminosulfonyl)phenyl]ethyl}-2-phenyl-2-(phenylsulfanyl)acetamide
SpectraBase Compound ID GgfT9z8PqDN
InChI InChI=1S/C22H22N2O3S2/c23-29(26,27)20-13-11-17(12-14-20)15-16-24-22(25)21(18-7-3-1-4-8-18)28-19-9-5-2-6-10-19/h1-14,21H,15-16H2,(H,24,25)(H2,23,26,27)
InChIKey YDMRHDOXVOGOFL-UHFFFAOYSA-N
Mol Weight 426.55 g/mol
Molecular Formula C22H22N2O3S2
Exact Mass 426.107185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KrVVVKGZDZI
Name N-{2-[4-(Aminosulfonyl)phenyl]ethyl}-2-phenyl-2-(phenylsulfanyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 426.107184921 u
Formula C22H22N2O3S2
InChI InChI=1S/C22H22N2O3S2/c23-29(26,27)20-13-11-17(12-14-20)15-16-24-22(25)21(18-7-3-1-4-8-18)28-19-9-5-2-6-10-19/h1-14,21H,15-16H2,(H,24,25)(H2,23,26,27)
InChIKey YDMRHDOXVOGOFL-UHFFFAOYSA-N
Molecular Weight 426.549 g/mol
SMILES N(C(C(SC1=CC=CC=C1)C=1C=CC=CC1)=O)CCC=1C=CC(S(=O)(=O)N)=CC1