Chem
J-GLOBAL ID：200907075876098075   Nikkaji number：J1.708.442I

N-[4-Nitro-2,5-bis[(4-mercaptophenyl)ethynyl]phenyl]acetamide

N-[4-ニトロ-2,5-ビス[(4-メルカプトフェニル)エチニル]フェニル]アセトアミド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C24H16N[N+]O2[O-]S2
Molecular formula furigana： C24-H16-N2-O3-S2
Molecular weight： 444.520
InChI： InChI=1S/C24H16N2O3S2/c1-16(27)25-23-14-20(9-3-18-6-12-22(31)13-7-18)24(26(28)29)15-19(23)8-2-17-4-10-21(30)11-5-17/h4-7,10-15,30-31H,1H3,(H,25,27)
InChI key： NZKZKAFGQMUTNN-UHFFFAOYSA-N
SMILES： CC(=O)Nc1cc(C#Cc2ccc(S)cc2)c(cc1C#Cc1ccc(S)cc1)[N+](=O)[O-]
Systematic name  (4)：
  • N-[4-ニトロ-3,6-ビス[(4-メルカプトフェニル)エチニル]フェニル]アセトアミド
  • N-[4-ニトロ-2,5-ビス[(4-メルカプトフェニル)エチニル]フェニル]アセトアミド
  • N-{4-ニトロ-2,5-ビス[2-(4-スルファニルフェニル)エチニル]フェニル}アセトアミド
  • N-{4-nitro-2,5-bis[2-(4-sulfanylphenyl)ethynyl]phenyl}acetamide
Other name (2)：
  • N-[4-Nitro-3,6-bis[(4-mercaptophenyl)ethynyl]phenyl]acetamide
  • N-[4-Nitro-2,5-bis[(4-mercaptophenyl)ethynyl]phenyl]acetamide
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