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3-Fluoranyl-N-[5-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-imidazolidin-1-yl]benzamide
SpectraBase Compound ID IqqB2f2a6pT
InChI InChI=1S/C26H23FN4O4S/c1-35-21-12-10-20(11-13-21)28-23(32)15-22-25(34)30(16-17-6-3-2-4-7-17)26(36)31(22)29-24(33)18-8-5-9-19(27)14-18/h2-14,22H,15-16H2,1H3,(H,28,32)(H,29,33)
InChIKey IBRQSQHZMJYWDR-UHFFFAOYSA-N
Mol Weight 506.55 g/mol
Molecular Formula C26H23FN4O4S
Exact Mass 506.142405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7kjyqlWBSAY
Name 3-Fluoranyl-N-[5-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-imidazolidin-1-yl]benzamide
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Formula C26H23FN4O4S
InChI InChI=1S/C26H23FN4O4S/c1-35-21-12-10-20(11-13-21)28-23(32)15-22-25(34)30(16-17-6-3-2-4-7-17)26(36)31(22)29-24(33)18-8-5-9-19(27)14-18/h2-14,22H,15-16H2,1H3,(H,28,32)(H,29,33)
InChIKey IBRQSQHZMJYWDR-UHFFFAOYSA-N
Molecular Weight 506.552 g/mol
SMILES N(N1C(N(C(C1CC(Nc1ccc(OC)cc1)=O)=O)Cc1ccccc1)=S)C(c1cc(F)ccc1)=O
SPLASH splash10-00dj-8910000000-f8e215beb8316800aa5f
Synonyms 3-Fluoro-N-[5-[2-(4-methoxyanilino)-2-oxoethyl]-4-oxo-3-(phenylmethyl)-2-sulfanylidene-1-imidazolidinyl]benzamide N-[3-benzyl-4-keto-5-[2-keto-2-(p-anisidino)ethyl]-2-thioxo-imidazolidin-1-yl]-3-fluoro-benzamide N-[3-benzyl-5-[2-(4-methoxyanilino)-2-oxo-ethyl]-4-oxo-2-thioxo-imidazolidin-1-yl]-3-fluoro-benzamide N-[3-benzyl-5-[2-(4-methoxyanilino)-2-oxoethyl]-4-oxo-2-sulfanylideneimidazolidin-1-yl]-3-fluorobenzamide
Wiley ID 1442766