Chem
J-GLOBAL ID：200907009163159314   Nikkaji number：J1.051.692G

NNC-92-1687

1-(3,4-ジヒドロキシフェニル)-2-(1H-ベンゾイミダゾール-2-イルチオ)エタノン
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： C15H12N2O3S
Molecular formula furigana： C15-H12-N2-O3-S
Molecular weight： 300.330
InChI： InChI=1S/C15H12N2O3S/c18-12-6-5-9(7-13(12)19)14(20)8-21-15-16-10-3-1-2-4-11(10)17-15/h1-7,18-19H,8H2,(H,16,17)
InChI key： NVYSVDRYESXWBD-UHFFFAOYSA-N
SMILES： Oc1ccc(cc1O)C(=O)CSc1nc2ccccc2[nH]1
Systematic name  (4)：
  • 1-(4,5-ジヒドロキシフェニル)-2-(1H-ベンゾイミダゾール-2-イルチオ)エタノン
  • 1-(3,4-ジヒドロキシフェニル)-2-(1H-ベンゾイミダゾール-2-イルチオ)エタノン
  • 2-(1H-1,3-ベンゾジアゾール-2-イルスルファニル)-1-(3,4-ジヒドロキシフェニル)エタン-1-オン
  • 2-(1H-1,3-benzodiazol-2-ylsulfanyl)-1-(3,4-dihydroxyphenyl)ethan-1-one
Other name (3)：
  • 1-(4,5-Dihydroxyphenyl)-2-(1H-benzimidazole-2-ylthio)ethanone
  • 1-(3,4-Dihydroxyphenyl)-2-(1H-benzimidazole-2-ylthio)ethanone
  • NNC-92-1687
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