Chem
J-GLOBAL ID：200907001158842536   Nikkaji number：J2.344.319H

2-[(Hexahydro-1H-1,4-diazepine-1-yl)(thiocarbonyl)thio]-2-methylpropionic acid

2-(1,4-ジアゼパン-1-カルボチオイルスルファニル)-2-メチルプロパン酸
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： C10H18N2O2S2
Molecular formula furigana： C10-H18-N2-O2-S2
Molecular weight： 262.390
InChI： InChI=1S/C10H18N2O2S2/c1-10(2,8(13)14)16-9(15)12-6-3-4-11-5-7-12/h11H,3-7H2,1-2H3,(H,13,14)
InChI key： OBGMGHUVRLFGCB-UHFFFAOYSA-N
SMILES： CC(C)(SC(=S)N1CCCNCC1)C(=O)O
Systematic name  (3)：
  • 2-[(ヘキサヒドロ-1H-1,4-ジアゼピン-1-イル)(チオカルボニル)チオ]-2-メチルプロピオン酸
  • 2-(1,4-ジアゼパン-1-カルボチオイルスルファニル)-2-メチルプロパン酸
  • 2-(1,4-diazepane-1-carbothioylsulfanyl)-2-methylpropanoic acid
Other name (1)：
  • 2-[(Hexahydro-1H-1,4-diazepine-1-yl)(thiocarbonyl)thio]-2-methylpropionic acid
Thsaurus map：
Thesaurus Map

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