Chem
J-GLOBAL ID:200907097995453600   Nikkaji number:J407.624I

N-[(2R)-3-[Methylthio]-2-[(tert-butoxycarbonyl)amino]propylidene]-2,3-dihydro-1H-indole-3-(ethanamine)N-oxide

N-[(2R)-3-[メチルチオ]-2-[(tert-ブトキシカルボニル)アミノ]プロピリデン]-2,3-ジヒドロ-1H-インドール-3-(エタンアミン)N-オキシド
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: C19H29N2[N+]O2[O-]S
Molecular formula furigana: C19-H29-N3-O3-S
Molecular weight: 379.520
InChI: InChI=1S/C19H29N3O3S/c1-19(2,3)25-18(23)21-15(13-26-4)12-22(24)10-9-14-11-20-17-8-6-5-7-16(14)17/h5-8,12,14-15,20H,9-11,13H2,1-4H3,(H,21,23)/t14?,15-/m1/s1
InChI key: FZFLDDSXLGEAQE-YSSOQSIOSA-N
SMILES: CSC[C@H](NC(=O)OC(C)(C)C)C=[N+]([O-])CCC1CNc2ccccc12
Systematic name  (3):
  • N-[(2R)-3-[メチルチオ]-2-[(tert-ブトキシカルボニル)アミノ]プロピリデン]-2,3-ジヒドロ-1H-インドール-3-(エタンアミン)N-オキシド
  • (2R)-2-{[(tert-ブトキシ)カルボニル]アミノ}-N-[2-(2,3-ジヒドロ-1H-インドール-3-イル)エチル]-3-(メチルスルファニル)プロパンイミン オキシド
  • (2R)-2-{[(tert-butoxy)carbonyl]amino}-N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-(methylsulfanyl)propanimine oxide
Other name (1):
  • N-[(2R)-3-[Methylthio]-2-[(tert-butoxycarbonyl)amino]propylidene]-2,3-dihydro-1H-indole-3-(ethanamine)N-oxide
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