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Thieno[2,3-d]pyrimidin-4(3H)-one, 5-(4-fluorophenyl)-2-[[(4-methoxyphenyl)methyl]thio]-3-phenyl-
SpectraBase Compound ID FiJXh345WPM
InChI InChI=1S/C26H19FN2O2S2/c1-31-21-13-7-17(8-14-21)15-33-26-28-24-23(25(30)29(26)20-5-3-2-4-6-20)22(16-32-24)18-9-11-19(27)12-10-18/h2-14,16H,15H2,1H3
InChIKey JOHNDVZZEGHZLP-UHFFFAOYSA-N
Mol Weight 474.57 g/mol
Molecular Formula C26H19FN2O2S2
Exact Mass 474.087198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdEQ4RgI4Pm
Name Thieno[2,3-d]pyrimidin-4(3H)-one, 5-(4-fluorophenyl)-2-[[(4-methoxyphenyl)methyl]thio]-3-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H19FN2O2S2
InChI InChI=1S/C26H19FN2O2S2/c1-31-21-13-7-17(8-14-21)15-33-26-28-24-23(25(30)29(26)20-5-3-2-4-6-20)22(16-32-24)18-9-11-19(27)12-10-18/h2-14,16H,15H2,1H3
InChIKey JOHNDVZZEGHZLP-UHFFFAOYSA-N
Molecular Weight 474.568 g/mol
SMILES COc1ccc(CSC2=Nc3c(C(N2c2ccccc2)=O)c(-c2ccc(cc2)F)cs3)cc1
SPLASH splash10-00di-3900000000-8c207f65f747fd390600
Source of Spectrum IY-1-4486-9
Synonyms 5-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylthio]-3-phenyl-4-thieno[2,3-d]pyrimidinone 5-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylthieno[2,3-d]pyrimidin-4-one 5-(4-fluorophenyl)-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenyl-thieno[2,3-d]pyrimidin-4-one
Wiley ID 1652852