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3-[3-(4-Oxoquinazolin-2-yl)propionoyl]-1,3-quinazolinone-2-thione
SpectraBase Compound ID CSO6CGX0rdv
InChI InChI=1S/C19H14N4O3S/c24-16(23-18(26)12-6-2-4-8-14(12)21-19(23)27)10-9-15-20-13-7-3-1-5-11(13)17(25)22-15/h1-8H,9-10H2,(H,21,27)(H,20,22,25)
InChIKey ZLEDUQZYRYDPDR-UHFFFAOYSA-N
Mol Weight 378.41 g/mol
Molecular Formula C19H14N4O3S
Exact Mass 378.078661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNrL5YyHs5N
Name 3-[3-(4-Oxoquinazolin-2-yl)propionoyl]-1,3-quinazolinone-2-thione
Comments Less than 3 mono-isotopic peaks
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Formula C19H14N4O3S
InChI InChI=1S/C19H14N4O3S/c24-16(23-18(26)12-6-2-4-8-14(12)21-19(23)27)10-9-15-20-13-7-3-1-5-11(13)17(25)22-15/h1-8H,9-10H2,(H,21,27)(H,20,22,25)
InChIKey ZLEDUQZYRYDPDR-UHFFFAOYSA-N
Molecular Weight 378.406 g/mol
SMILES N1c2c(C(N(C(CCC3=Nc4c(C(N3)=O)cccc4)=O)C1=S)=O)cccc2
SPLASH splash10-004j-0900000000-fbe28eca1113f7509711
Source of Spectrum Y1-37-1155-6
Synonyms 3-[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one 3-[3-(4-oxo-1H-quinazolin-2-yl)propanoyl]-2-sulfanylidene-1H-quinazolin-4-one 3-[3-(4-oxo-1H-quinazolin-2-yl)propanoyl]-2-thioxo-1H-quinazolin-4-one 3-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoyl]-2-sulfanylidene-1H-quinazolin-4-one
Wiley ID 1527543