Chem
J-GLOBAL ID：200907048944020031   Nikkaji number：J1.376.538C

1-(Phenylthio)-7,8-dimethoxy-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carbaldehyde

1-(フェニルチオ)-7,8-ジメトキシ-1,2,4,5-テトラヒドロ-3H-3-ベンゾアゼピン-3-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/c1-22-17-10-14-8-9-20(13-21)12-19(16(14)11-18(17)23-2)24-15-6-4-3-5-7-15/h3-7,10-11,13,19H,8-9,12H2,1-2H3
InChI key： FSWWYYBPYLAIFB-UHFFFAOYSA-N
SMILES： COc1cc2CCN(CC(Sc3ccccc3)c2cc1OC)C=O
Systematic name  (3)：
  • 1-(フェニルチオ)-7,8-ジメトキシ-1,2,4,5-テトラヒドロ-3H-3-ベンゾアゼピン-3-カルボアルデヒド
  • 7,8-ジメトキシ-1-(フェニルスルファニル)-2,3,4,5-テトラヒドロ-1H-3-ベンゾアゼピン-3-カルバルデヒド
  • 7,8-dimethoxy-1-(phenylsulfanyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-3-carbaldehyde
Other name (1)：
  • 1-(Phenylthio)-7,8-dimethoxy-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carbaldehyde
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