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3-(1-HYDROXY-NAPHTHALEN-2-YL)-N-PHENYL-5-(3-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE

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3-(1-HYDROXY-NAPHTHALEN-2-YL)-N-PHENYL-5-(3-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE
SpectraBase Compound ID 586tOiGTa6J
InChI InChI=1S/C27H23N3O2S/c1-32-21-12-7-9-19(16-21)25-17-24(23-15-14-18-8-5-6-13-22(18)26(23)31)29-30(25)27(33)28-20-10-3-2-4-11-20/h2-16,25,31H,17H2,1H3,(H,28,33)
InChIKey MABCMXIRBIMCAR-UHFFFAOYSA-N
Mol Weight 453.56 g/mol
Molecular Formula C27H23N3O2S
Exact Mass 453.151098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5mAISjnhuYP
Name 3-(1-HYDROXY-NAPHTHALEN-2-YL)-N-PHENYL-5-(3-METHOXYPHENYL)-PYRAZOLINE-1-CARBOTHIOAMIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H23N3O2S
InChI InChI=1S/C27H23N3O2S/c1-32-21-12-7-9-19(16-21)25-17-24(23-15-14-18-8-5-6-13-22(18)26(23)31)29-30(25)27(33)28-20-10-3-2-4-11-20/h2-16,25,31H,17H2,1H3,(H,28,33)
InChIKey MABCMXIRBIMCAR-UHFFFAOYSA-N
Literature Reference Author H.YOON,S.AHN,M.PARK,D.W.KIM,S.H.KIM,D.KOH,Y.LIM
Literature Reference Citation MAGN.RES.CHEM.,51,500(2013)
Literature Reference DOI 10.1002/mrc.3971
Molecular Weight 453.559 g/mol
Solvent DMSO-D6
Source File Reference UWIR13423