Chem
J-GLOBAL ID:200907002186638762   Nikkaji number:J847.041C

2-Phenyl-3-thioxo-4α-methyl-2,3,3aβ,4,7,7aβ-hexahydro-1H-isoindol-1-one

2-フェニル-3-チオキソ-4α-メチル-2,3,3aβ,4,7,7aβ-ヘキサヒドロ-1H-イソインドール-1-オン
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: C15H15NOS
Molecular formula furigana: C15-H15-N-O-S
Molecular weight: 257.350
InChI: InChI=1S/C15H15NOS/c1-10-6-5-9-12-13(10)15(18)16(14(12)17)11-7-3-2-4-8-11/h2-8,10,12-13H,9H2,1H3/t10-,12+,13-/m1/s1
InChI key: SNQXINDZHZNJMV-KGYLQXTDSA-N
SMILES: C[C@@H]1C=CC[C@H]2[C@@H]1C(=S)N(C2=O)c1ccccc1
Systematic name  (3):
  • 2-フェニル-3-チオキソ-4α-メチル-2,3,3aβ,4,7,7aβ-ヘキサヒドロ-1H-イソインドール-1-オン
  • (3aR,4R,7aS)-4-メチル-2-フェニル-3-スルファニリデン-2,3,3a,4,7,7a-ヘキサヒドロ-1H-イソインドール-1-オン
  • (3aR,4R,7aS)-4-methyl-2-phenyl-3-sulfanylidene-2,3,3a,4,7,7a-hexahydro-1H-isoindol-1-one
Other name (1):
  • 2-Phenyl-3-thioxo-4α-methyl-2,3,3aβ,4,7,7aβ-hexahydro-1H-isoindol-1-one
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