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3-{4-[4-(4-Chlorophenyl)methylidene-5-oxo-4,5-dihydro-1,3-oxazol-2-yl]phenyl}-2-(2-thienyl)-2,3-dihydroquinazolin-4(1H)-one
SpectraBase Compound ID FVr9VWCS0Sv
InChI InChI=1S/C28H18ClN3O3S/c29-19-11-7-17(8-12-19)16-23-28(34)35-26(31-23)18-9-13-20(14-10-18)32-25(24-6-3-15-36-24)30-22-5-2-1-4-21(22)27(32)33/h1-16,25,30H
InChIKey OHPYZRXLJAMAAB-UHFFFAOYSA-N
Mol Weight 511.98 g/mol
Molecular Formula C28H18ClN3O3S
Exact Mass 511.07574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tZCvFcCXl3
Name 3-{4-[4-(4-Chlorophenyl)methylidene-5-oxo-4,5-dihydro-1,3-oxazol-2-yl]phenyl}-2-(2-thienyl)-2,3-dihydroquinazolin-4(1H)-one
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Formula C28H18ClN3O3S
InChI InChI=1S/C28H18ClN3O3S/c29-19-11-7-17(8-12-19)16-23-28(34)35-26(31-23)18-9-13-20(14-10-18)32-25(24-6-3-15-36-24)30-22-5-2-1-4-21(22)27(32)33/h1-16,25,30H
InChIKey OHPYZRXLJAMAAB-UHFFFAOYSA-N
Literature Reference DOI 10.1007/s10593-015-1705-6
Molecular Weight 511.983 g/mol
SMILES N1c2ccccc2C(N(C1c1sccc1)c1ccc(cc1)C1=NC(C(O1)=O)=Cc1ccc(cc1)Cl)=O
SPLASH splash10-03e9-4790040000-1c5f48185459e519960a
Source of Spectrum HC-51-344-5d
Synonyms 4-(4-Chlorobenzylidene)-2-(4-(4-oxo-2-(thiophen-2-yl)-1,4-dihydroquinazolin-3(2H)-yl)phenyl)oxazol-5(4H)-one
Wiley ID 1806422