Chem
J-GLOBAL ID:201007072619820993   Nikkaji number:J2.887.746C

1-Oxo-2-methyl-5-(ethylthiomethyl)-7-(benzyloxy)isoindoline-4-carboxylic acid ethyl ester

1-オキソ-2-メチル-5-(エチルチオメチル)-7-(ベンジルオキシ)イソインドリン-4-カルボン酸エチル
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: C22H25NO4S
Molecular formula furigana: C22-H25-N-O4-S
Molecular weight: 399.510
InChI: InChI=1S/C22H25NO4S/c1-4-26-22(25)19-16(14-28-5-2)11-18(20-17(19)12-23(3)21(20)24)27-13-15-9-7-6-8-10-15/h6-11H,4-5,12-14H2,1-3H3
InChI key: PDGVIPLYRRATCU-UHFFFAOYSA-N
SMILES: CCOC(=O)c1c2CN(C)C(=O)c2c(OCc2ccccc2)cc1CSCC
Systematic name  (3):
  • 1-オキソ-2-メチル-5-(エチルチオメチル)-7-(ベンジルオキシ)イソインドリン-4-カルボン酸エチル
  • エチル 7-(ベンジルオキシ)-5-[(エチルスルファニル)メチル]-2-メチル-1-オキソ-2,3-ジヒドロ-1H-イソインドール-4-カルボキシラート
  • ethyl 7-(benzyloxy)-5-[(ethylsulfanyl)methyl]-2-methyl-1-oxo-2,3-dihydro-1H-isoindole-4-carboxylate
Other name (1):
  • 1-Oxo-2-methyl-5-(ethylthiomethyl)-7-(benzyloxy)isoindoline-4-carboxylic acid ethyl ester
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