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2-[[1-oxo-2-[(1-phenyl-2-benzimidazolyl)thio]ethyl]amino]benzoic acid methyl ester
SpectraBase Compound ID GtdMNrEriDT
InChI InChI=1S/C23H19N3O3S/c1-29-22(28)17-11-5-6-12-18(17)24-21(27)15-30-23-25-19-13-7-8-14-20(19)26(23)16-9-3-2-4-10-16/h2-14H,15H2,1H3,(H,24,27)
InChIKey HRPAHCVMNPFTDF-UHFFFAOYSA-N
Mol Weight 417.48 g/mol
Molecular Formula C23H19N3O3S
Exact Mass 417.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43wQGdbgy8
Name 2-[[1-oxo-2-[(1-phenyl-2-benzimidazolyl)thio]ethyl]amino]benzoic acid methyl ester
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Formula C23H19N3O3S
InChI InChI=1S/C23H19N3O3S/c1-29-22(28)17-11-5-6-12-18(17)24-21(27)15-30-23-25-19-13-7-8-14-20(19)26(23)16-9-3-2-4-10-16/h2-14H,15H2,1H3,(H,24,27)
InChIKey HRPAHCVMNPFTDF-UHFFFAOYSA-N
Molecular Weight 417.483 g/mol
SMILES N(c1c(C(=O)OC)cccc1)C(CSc1[n](c2ccccc2n1)-c1ccccc1)=O
SPLASH splash10-00mo-7690000000-02774825fcf40815a59e
Synonyms 2-[[2-[(1-phenylbenzimidazol-2-yl)thio]acetyl]amino]benzoic acid methyl ester Methyl 2-({[(1-phenyl-1H-benzimidazol-2-yl)sulfanyl]acetyl}amino)benzoate Methyl 2-[2-(1-phenylbenzimidazol-2-yl)sulfanylethanoylamino]benzoate Methyl 2-[[2-(1-phenylbenzimidazol-2-yl)sulfanylacetyl]amino]benzoate
Wiley ID 1455262