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2-[[2-(2-isopropoxyanilino)-2-keto-ethyl]thio]-N-(2-naphthyl)acetamide
SpectraBase Compound ID 7mRnhEjxoUO
InChI InChI=1S/C23H24N2O3S/c1-16(2)28-21-10-6-5-9-20(21)25-23(27)15-29-14-22(26)24-19-12-11-17-7-3-4-8-18(17)13-19/h3-13,16H,14-15H2,1-2H3,(H,24,26)(H,25,27)
InChIKey ZUTBQMUAXBPOSN-UHFFFAOYSA-N
Mol Weight 408.52 g/mol
Molecular Formula C23H24N2O3S
Exact Mass 408.150764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D50vgNkSEHn
Name 2-[[2-(2-Isopropoxyanilino)-2-keto-ethyl]thio]-N-(2-naphthyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 408.150763812 u
Formula C23H24N2O3S
InChI InChI=1S/C23H24N2O3S/c1-16(2)28-21-10-6-5-9-20(21)25-23(27)15-29-14-22(26)24-19-12-11-17-7-3-4-8-18(17)13-19/h3-13,16H,14-15H2,1-2H3,(H,24,26)(H,25,27)
InChIKey ZUTBQMUAXBPOSN-UHFFFAOYSA-N
Molecular Weight 408.516 g/mol
SMILES C1=CC=2C=CC(NC(CSCC(NC3=C(OC(C)C)C=CC=C3)=O)=O)=CC2C=C1