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3-Methoxy-6-phenyl-8-methylpyrazolo[3,4-b]thieno[2,3-d]pyridine - 2-(N-Phenylpiperazine-carboxamide)
SpectraBase Compound ID 78ZuKT2j5Wn
InChI InChI=1S/C27H25N5O2S/c1-18-22-24-21(17-28-26(22)32(29-18)20-11-7-4-8-12-20)23(34-2)25(35-24)27(33)31-15-13-30(14-16-31)19-9-5-3-6-10-19/h3-12,17H,13-16H2,1-2H3
InChIKey PLKYGCRMQCQIMJ-UHFFFAOYSA-N
Mol Weight 483.59 g/mol
Molecular Formula C27H25N5O2S
Exact Mass 483.172896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SI4d9DHjvK
Name 3-METHOXY-6-PHENYL-8-METHYL-PYRAZOLO-[3,4-B]-THIENO-[2,3-D]-PYRIDINE-2-(N-PHENYL)-PIPERAZINE-CARBOXAMIDE
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H25N5O2S
InChI InChI=1S/C27H25N5O2S/c1-18-22-24-21(17-28-26(22)32(29-18)20-11-7-4-8-12-20)23(34-2)25(35-24)27(33)31-15-13-30(14-16-31)19-9-5-3-6-10-19/h3-12,17H,13-16H2,1-2H3
InChIKey PLKYGCRMQCQIMJ-UHFFFAOYSA-N
Literature Reference Author A.S.D.CARVALHO,C.A.M.FRAGA,K.C.M.D.SILVA,A.L.P.MIRANDA,E.J.B ARREIRO
Literature Reference Citation J.BRAZ.CHEM.SOC.,7,247(1996)
Literature Reference DOI 10.5935/0103-5053.19960051
Molecular Weight 483.588 g/mol
Solvent DMSO-D6
Source File Reference UWPA1144