Chem
J-GLOBAL ID:200907026139610953   Nikkaji number:J1.041.055J

Dithiocarbonic acid O-ethyl S-[(3-benzoyl-5-(3-oxobutyl)cyclopentyl)methyl] ester

ジチオ炭酸O-エチルS-[(3-ベンゾイル-5-(3-オキソブチル)シクロペンチル)メチル]
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: C20H26O3S2
Molecular formula furigana: C20-H26-O3-S2
Molecular weight: 378.550
InChI: InChI=1S/C20H26O3S2/c1-3-23-20(24)25-13-18-12-17(11-16(18)10-9-14(2)21)19(22)15-7-5-4-6-8-15/h4-8,16-18H,3,9-13H2,1-2H3
InChI key: PTOCFUYAVNYUKT-UHFFFAOYSA-N
SMILES: CCOC(=S)SCC1CC(CC1CCC(=O)C)C(=O)c1ccccc1
Systematic name  (3):
  • ジチオ炭酸O-エチルS-[(3-ベンゾイル-5-(3-オキソブチル)シクロペンチル)メチル]
  • 4-(4-ベンゾイル-2-{[(エトキシメタンチオイル)スルファニル]メチル}シクロペンチル)ブタン-2-オン
  • 4-(4-benzoyl-2-{[(ethoxymethanethioyl)sulfanyl]methyl}cyclopentyl)butan-2-one
Other name (1):
  • Dithiocarbonic acid O-ethyl S-[(3-benzoyl-5-(3-oxobutyl)cyclopentyl)methyl] ester
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