Chem
J-GLOBAL ID：201607008807065412   Nikkaji number：J3.464.800J

1-Tosyl-3-amino-5-phenylthio-2,7-dihydro-1H-azepine-4-carboxylic acid ethyl ester

1-トシル-3-アミノ-5-フェニルチオ-2,7-ジヒドロ-1H-アゼピン-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： C22H24N2O4S2
Molecular formula furigana： C22-H24-N2-O4-S2
Molecular weight： 444.560
InChI： InChI=1S/C22H24N2O4S2/c1-3-28-22(25)21-19(23)15-24(30(26,27)18-11-9-16(2)10-12-18)14-13-20(21)29-17-7-5-4-6-8-17/h4-13H,3,14-15,23H2,1-2H3
InChI key： GPKOVCCOMNPHIB-UHFFFAOYSA-N
SMILES： CCOC(=O)C1=C(N)CN(CC=C1Sc1ccccc1)S(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • 1-トシル-3-アミノ-5-フェニルチオ-2,7-ジヒドロ-1H-アゼピン-4-カルボン酸エチル
  • エチル 3-アミノ-1-(4-メチルベンゼンスルホニル)-5-(フェニルスルファニル)-2,7-ジヒドロ-1H-アゼピン-4-カルボキシラート
  • ethyl 3-amino-1-(4-methylbenzenesulfonyl)-5-(phenylsulfanyl)-2,7-dihydro-1H-azepine-4-carboxylate
Other name (1)：
  • 1-Tosyl-3-amino-5-phenylthio-2,7-dihydro-1H-azepine-4-carboxylic acid ethyl ester
Thsaurus map：
Thesaurus Map

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