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6-(3-Benzoylaminopyran-2-on-6-yl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
SpectraBase Compound ID D82PMOUzDik
InChI InChI=1S/C29H20N4O3S/c1-18-23-24(33-16-8-9-17-33)25(37-28(23)32-26(30-18)19-10-4-2-5-11-19)22-15-14-21(29(35)36-22)31-27(34)20-12-6-3-7-13-20/h2-17H,1H3,(H,31,34)
InChIKey IPNYVNKGAKUBQM-UHFFFAOYSA-N
Mol Weight 504.56 g/mol
Molecular Formula C29H20N4O3S
Exact Mass 504.125612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aas1rxolVUR
Name 6-(3-Benzoylaminopyran-2-on-6-yl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H20N4O3S
InChI InChI=1S/C29H20N4O3S/c1-18-23-24(33-16-8-9-17-33)25(37-28(23)32-26(30-18)19-10-4-2-5-11-19)22-15-14-21(29(35)36-22)31-27(34)20-12-6-3-7-13-20/h2-17H,1H3,(H,31,34)
InChIKey IPNYVNKGAKUBQM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200500048
Molecular Weight 504.564 g/mol
SMILES N(C(c1ccccc1)=O)C=1C(OC(=CC1)c1c(c2c(nc(nc2C)-c2ccccc2)s1)-[n]1cccc1)=O
SPLASH splash10-0a4i-4901120000-618a7a0af0a319c38df5
Source of Spectrum QA-52-323-30b
Synonyms N-(6-(4-methyl-2-phenyl-5-(1H-pyrrol-1-yl)thieno[2,3-d]pyrimidin-6-yl)-2-oxo-2H-pyran-3-yl)benzamide
Wiley ID 1796100