Chem
J-GLOBAL ID：201507072788867822   Nikkaji number：J3.351.255D

[(S)-1-[(Carbamoylmethyl)carbamoyl]-5-(thioacetylamino)pentyl]carbamic acid benzyl ester

[(S)-1-[(カルバモイルメチル)カルバモイル]-5-(チオアセチルアミノ)ペンチル]カルバミド酸ベンジル
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： C18H26N4O4S
Molecular formula furigana： C18-H26-N4-O4-S
Molecular weight： 394.490
InChI： InChI=1S/C18H26N4O4S/c1-13(27)20-10-6-5-9-15(17(24)21-11-16(19)23)22-18(25)26-12-14-7-3-2-4-8-14/h2-4,7-8,15H,5-6,9-12H2,1H3,(H2,19,23)(H,20,27)(H,21,24)(H,22,25)/t15-/m0/s1
InChI key： QOKJJYAIUHYLPF-HNNXBMFYSA-N
SMILES： CC(=S)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)N
Systematic name  (3)：
  • [(S)-1-[(カルバモイルメチル)カルバモイル]-5-(チオアセチルアミノ)ペンチル]カルバミド酸ベンジル
  • ベンジル N-[(1S)-1-[(カルバモイルメチル)カルバモイル]-5-エタンチオアミドペンチル]カルバマート
  • benzyl N-[(1S)-1-[(carbamoylmethyl)carbamoyl]-5-ethanethioamidopentyl]carbamate
Other name (1)：
  • [(S)-1-[(Carbamoylmethyl)carbamoyl]-5-(thioacetylamino)pentyl]carbamic acid benzyl ester
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