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Benzoic acid, 2-[[2-[[3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID LxddZJCl2iX
InChI InChI=1S/C25H21N3O5S/c1-32-21-14-8-7-13-20(21)28-23(30)16-9-3-5-11-18(16)27-25(28)34-15-22(29)26-19-12-6-4-10-17(19)24(31)33-2/h3-14H,15H2,1-2H3,(H,26,29)
InChIKey XUBGABKTHMDEQD-UHFFFAOYSA-N
Mol Weight 475.52 g/mol
Molecular Formula C25H21N3O5S
Exact Mass 475.120192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWAWIAIA7FE
Name Benzoic acid, 2-[[2-[[3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetyl]amino]-, methyl ester
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Formula C25H21N3O5S
InChI InChI=1S/C25H21N3O5S/c1-32-21-14-8-7-13-20(21)28-23(30)16-9-3-5-11-18(16)27-25(28)34-15-22(29)26-19-12-6-4-10-17(19)24(31)33-2/h3-14H,15H2,1-2H3,(H,26,29)
InChIKey XUBGABKTHMDEQD-UHFFFAOYSA-N
Molecular Weight 475.519 g/mol
SMILES N(C(CSC1=Nc2c(C(N1c1c(cccc1)OC)=O)cccc2)=O)c1ccccc1C(OC)=O
SPLASH splash10-004i-6937000000-0467b09f7808ad9fd562
Source of Spectrum IY-2-5086-4
Synonyms Methyl 2-(2-{[3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamido)benzoate 2-[[2-[[3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester Methyl 2-[[2-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]benzoate Methyl 2-[[2-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]benzoate Methyl 2-[2-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzoate
Wiley ID 1658847