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2-{p-Methoxy-alpha-[(4-p-tolyl-2-thiazolyl)amino]benzyl}-1-naphthol
SpectraBase Compound ID LwLjpPREnAt
InChI InChI=1S/C28H24N2O2S/c1-18-7-9-20(10-8-18)25-17-33-28(29-25)30-26(21-11-14-22(32-2)15-12-21)24-16-13-19-5-3-4-6-23(19)27(24)31/h3-17,26,31H,1-2H3,(H,29,30)
InChIKey NLQADSCGRNWNNI-UHFFFAOYSA-N
Mol Weight 452.57 g/mol
Molecular Formula C28H24N2O2S
Exact Mass 452.155849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CBHyBoCxbfA
Name 2-{p-Methoxy-alpha-[(4-p-tolyl-2-thiazolyl)amino]benzyl}-1-naphthol
Comments Computed using HOSE algorithm
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Exact Mass 452.155849193 u
Formula C28H24N2O2S
InChI InChI=1S/C28H24N2O2S/c1-18-7-9-20(10-8-18)25-17-33-28(29-25)30-26(21-11-14-22(32-2)15-12-21)24-16-13-19-5-3-4-6-23(19)27(24)31/h3-17,26,31H,1-2H3,(H,29,30)
InChIKey NLQADSCGRNWNNI-UHFFFAOYSA-N
Molecular Weight 452.572 g/mol
SMILES OC=1C2=C(C=CC1C(C=1C=CC(=CC1)OC)NC1=NC(=CS1)C=1C=CC(=CC1)C)C=CC=C2