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4-[[(4-bromophenyl)sulfonyl](isonicotinoyl)amino]-1-naphthyl isonicotinate
SpectraBase Compound ID 3wuStln3sYM
InChI InChI=1S/C28H18BrN3O5S/c29-21-5-7-22(8-6-21)38(35,36)32(27(33)19-11-15-30-16-12-19)25-9-10-26(24-4-2-1-3-23(24)25)37-28(34)20-13-17-31-18-14-20/h1-18H
InChIKey DEFPYOZZONNSBA-UHFFFAOYSA-N
Mol Weight 588.43 g/mol
Molecular Formula C28H18BrN3O5S
Exact Mass 587.015055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lvTiYDOEcu
Name 4-[[(4-bromophenyl)sulfonyl](isonicotinoyl)amino]-1-naphthyl isonicotinate
Alternate Name(s) 4-Pyridinecarboxylic acid[4-[(4-bromophenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]-1-naphthalenyl]ester Isonicotinic acid 4-[(4-bromo-benzenesulfonyl)-(pyridine-4-carbonyl)-amino]-naphthalen-1-yl ester isonicotinic acid[4-[brosyl(isonicotinoyl)amino]-1-naphthyl]ester [4-[(4-bromophenyl)sulfonyl-(pyridine-4-carbonyl)amino]-1-naphthyl]pyridine-4-carboxylate [4-[(4-bromophenyl)sulfonyl-(pyridine-4-carbonyl)amino]naphthalen-1-yl]pyridine-4-carboxylate [4-[(4-bromophenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]naphthalen-1-yl]pyridine-4-carboxylate 4-Pyridinecarboxylic acid [4-[(4-bromophenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]-1-naphthalenyl] ester [4-[(4-bromophenyl)sulfonyl-(pyridine-4-carbonyl)amino]naphthalen-1-yl] pyridine-4-carboxylate [4-[(4-bromophenyl)sulfonyl-(pyridine-4-carbonyl)amino]-1-naphthyl] pyridine-4-carboxylate [4-[(4-bromophenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate
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Formula C28H18BrN3O5S
InChI InChI=1S/C28H18BrN3O5S/c29-21-5-7-22(8-6-21)38(35,36)32(27(33)19-11-15-30-16-12-19)25-9-10-26(24-4-2-1-3-23(24)25)37-28(34)20-13-17-31-18-14-20/h1-18H
InChIKey DEFPYOZZONNSBA-UHFFFAOYSA-N
Molecular Weight 588.432 g/mol
SMILES c1cccc2c1c(ccc2OC(=O)c1ccncc1)N(S(=O)(c1ccc(cc1)Br)=O)C(c1ccncc1)=O
SPLASH splash10-0a4i-5910000000-11341bdeaf97c1539ca9
Wiley ID 1444336