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4-[[2-[1-(4-fluorophenyl)-3-[2-(4-morpholinyl)ethyl]-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid methyl ester
SpectraBase Compound ID HR5BIeVJSz
InChI InChI=1S/C25H27FN4O5S/c1-34-24(33)17-2-6-19(7-3-17)27-22(31)16-21-23(32)30(20-8-4-18(26)5-9-20)25(36)29(21)11-10-28-12-14-35-15-13-28/h2-9,21H,10-16H2,1H3,(H,27,31)
InChIKey SAUOHVPUYBKBNN-UHFFFAOYSA-N
Mol Weight 514.57 g/mol
Molecular Formula C25H27FN4O5S
Exact Mass 514.168619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UfQ79Mf60w
Name 4-[[2-[1-(4-fluorophenyl)-3-[2-(4-morpholinyl)ethyl]-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid methyl ester
Alternate Name(s) 4-[[2-[1-(4-fluorophenyl)-5-keto-3-(2-morpholinoethyl)-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid methyl ester Methyl 4-[2-[1-(4-fluorophenyl)-3-(2-morpholin-4-ylethyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Methyl 4-[[2-[1-(4-fluorophenyl)-3-(2-morpholin-4-ylethyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Methyl 4-[[2-[1-(4-fluorophenyl)-3-(2-morpholinoethyl)-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate
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Formula C25H27FN4O5S
InChI InChI=1S/C25H27FN4O5S/c1-34-24(33)17-2-6-19(7-3-17)27-22(31)16-21-23(32)30(20-8-4-18(26)5-9-20)25(36)29(21)11-10-28-12-14-35-15-13-28/h2-9,21H,10-16H2,1H3,(H,27,31)
InChIKey SAUOHVPUYBKBNN-UHFFFAOYSA-N
Molecular Weight 514.572 g/mol
SMILES N(C(CC1C(N(C(N1CCN1CCOCC1)=S)c1ccc(cc1)F)=O)=O)c1ccc(C(=O)OC)cc1
SPLASH splash10-0udi-2900000000-f6968051a6016608d51b
Wiley ID 1454800