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6-(3-Acetamidopyran-2-on-6-yl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
SpectraBase Compound ID bY2K3UfCF4
InChI InChI=1S/C24H18N4O3S/c1-14-19-20(28-12-6-7-13-28)21(18-11-10-17(24(30)31-18)26-15(2)29)32-23(19)27-22(25-14)16-8-4-3-5-9-16/h3-13H,1-2H3,(H,26,29)
InChIKey KLAMQXGLLHYHIV-UHFFFAOYSA-N
Mol Weight 442.49 g/mol
Molecular Formula C24H18N4O3S
Exact Mass 442.109962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1I8U9hjVuO1
Name 6-(3-Acetamidopyran-2-on-6-yl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
Alternate Name(s) N-(6-(4-methyl-2-phenyl-5-(1H-pyrrol-1-yl)thieno[2,3-d]pyrimidin-6-yl)-2-oxo-2H-pyran-3-yl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N4O3S
InChI InChI=1S/C24H18N4O3S/c1-14-19-20(28-12-6-7-13-28)21(18-11-10-17(24(30)31-18)26-15(2)29)32-23(19)27-22(25-14)16-8-4-3-5-9-16/h3-13H,1-2H3,(H,26,29)
InChIKey KLAMQXGLLHYHIV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200500048
Molecular Weight 442.493 g/mol
SMILES N(C(C)=O)C=1C(OC(=CC1)c1c(c2c(nc(nc2C)-c2ccccc2)s1)-[n]1cccc1)=O
SPLASH splash10-05gi-3789100000-8a66c94d664ec721f4a4
Source of Spectrum QA-52-323-30a
Wiley ID 1796099