Chem
J-GLOBAL ID：200907033786892002   Nikkaji number：J1.521.069I

5-(Phenylthio)-6,9-dimethoxy-1,3,4,5-tetrahydro-2H-2-benzazepine-2-carbaldehyde

5-(フェニルチオ)-6,9-ジメトキシ-1,3,4,5-テトラヒドロ-2H-2-ベンゾアゼピン-2-カルボアルデヒド
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： C19H21NO3S
Molecular formula furigana： C19-H21-N-O3-S
Molecular weight： 343.440
InChI： InChI=1S/C19H21NO3S/c1-22-16-8-9-17(23-2)19-15(16)12-20(13-21)11-10-18(19)24-14-6-4-3-5-7-14/h3-9,13,18H,10-12H2,1-2H3
InChI key： WFOIAJSWRIMTDR-UHFFFAOYSA-N
SMILES： COc1ccc(OC)c2C(CCN(Cc12)C=O)Sc1ccccc1
Systematic name  (3)：
  • 5-(フェニルチオ)-6,9-ジメトキシ-1,3,4,5-テトラヒドロ-2H-2-ベンゾアゼピン-2-カルボアルデヒド
  • 6,9-ジメトキシ-5-(フェニルスルファニル)-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-2-カルバルデヒド
  • 6,9-dimethoxy-5-(phenylsulfanyl)-2,3,4,5-tetrahydro-1H-2-benzazepine-2-carbaldehyde
Other name (1)：
  • 5-(Phenylthio)-6,9-dimethoxy-1,3,4,5-tetrahydro-2H-2-benzazepine-2-carbaldehyde
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