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4-Amino-5-(5-bromothiophene-2-carbonyl)-2-(phenylamino)-N-(p-tolyl)thiophene-3-carboxamide
SpectraBase Compound ID Fi8hiP7bXcK
InChI InChI=1S/C23H18BrN3O2S2/c1-13-7-9-15(10-8-13)26-22(29)18-19(25)21(20(28)16-11-12-17(24)30-16)31-23(18)27-14-5-3-2-4-6-14/h2-12,27H,25H2,1H3,(H,26,29)
InChIKey DAYYANMSKCORMP-UHFFFAOYSA-N
Mol Weight 512.44 g/mol
Molecular Formula C23H18BrN3O2S2
Exact Mass 511.002382 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQa9SvaCs08
Name 4-Amino-5-(5-bromothiophene-2-carbonyl)-2-(phenylamino)-N-(p-tolyl)thiophene-3-carboxamide
Appearance Yellow crystals
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Formula C23H18BrN3O2S2
InChI InChI=1S/C23H18BrN3O2S2/c1-13-7-9-15(10-8-13)26-22(29)18-19(25)21(20(28)16-11-12-17(24)30-16)31-23(18)27-14-5-3-2-4-6-14/h2-12,27H,25H2,1H3,(H,26,29)
InChIKey DAYYANMSKCORMP-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4122
Molecular Weight 512.440 g/mol
SMILES N(c1sc(c(c1C(=O)Nc1ccc(cc1)C)N)C(c1ccc(s1)Br)=O)c1ccccc1
SPLASH splash10-0a4i-9000000000-3f979a5a82ec557199d2
Source of Spectrum Y-57-4161-25b
Wiley ID 1859933