Chem
J-GLOBAL ID：200907011482681001   Nikkaji number：J513.474I

11-[[2-[(Phenylsulfonyl)amino]ethyl]thio]-6,11-dihydrodibenz[b,e]oxepin-2-carboxylic acid

11-[[2-[(フェニルスルホニル)アミノ]エチル]チオ]-6,11-ジヒドロジベンゾ[b,e]オキセピン-2-カルボン酸
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： C23H21NO5S2
Molecular formula furigana： C23-H21-N-O5-S2
Molecular weight： 455.540
InChI： InChI=1S/C23H21NO5S2/c25-23(26)16-10-11-21-20(14-16)22(19-9-5-4-6-17(19)15-29-21)30-13-12-24-31(27,28)18-7-2-1-3-8-18/h1-11,14,22,24H,12-13,15H2,(H,25,26)
InChI key： WBPHAIFIMCCUJM-UHFFFAOYSA-N
SMILES： OC(=O)c1ccc2OCc3ccccc3C(SCCNS(=O)(=O)c3ccccc3)c2c1
Systematic name  (5)：
  • 6,11-ジヒドロ-11-[[2-[(フェニルスルホニル)アミノ]エチル]チオ]ジベンゾ[b,e]オキセピン-2-カルボン酸
  • 11-[[2-[[フェニルスルホニル]アミノ]エチル]チオ]-6,11-ジヒドロジベンゾ[b,e]オキセピン-2-カルボン酸
  • 11-[[2-[(フェニルスルホニル)アミノ]エチル]チオ]-6,11-ジヒドロジベンゾ[b,e]オキセピン-2-カルボン酸
  • 2-[(2-ベンゼンスルホンアミドエチル)スルファニル]-9-オキサトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-5-カルボン酸
  • 2-[(2-benzenesulfonamidoethyl)sulfanyl]-9-oxatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-5-carboxylic acid
Other name (3)：
  • 11-[[2-[(Phenylsulfonyl)amino]ethyl]thio]-6,11-dihydrodibenz[b,e]oxepin-2-carboxylic acid
  • 11-[[2-[[Phenylsulfonyl]amino]ethyl]thio]-6,11-dihydrodibenz[b,e]oxepin-2-carboxylic acid
  • 6,11-Dihydro-11-[[2-[(phenylsulfonyl)amino]ethyl]thio]dibenz[b,e]oxepin-2-carboxylic acid
Thsaurus map：
Thesaurus Map

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