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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I2BLcDaqw9O
Name 3-Methoxy-6-phenyl-8-methylpyrazolo[3,4-b]thieno[2,3-d]pyridine - 2-(N-Phenylpiperazine-carboxamide)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 483.590 g/mol
SMILES c1(sc2c3c([n](-c4ccccc4)nc3C)ncc2c1OC)C(N1CCN(CC1)c1ccccc1)=O
SPLASH splash10-0230-0009500000-1121713f7dc42b0129b8
Source of Spectrum D9-7-254-3
Wiley ID 1546274