Chem
J-GLOBAL ID:200907018338733352   Nikkaji number:J1.811.061J

(3S)-3-(9H-Fluorene-9-ylmethoxycarbonylamino)-4-oxo-4-(2-pyridinylthio)butanoic acid tert-butyl ester

(3S)-3-(9H-フルオレン-9-イルメトキシカルボニルアミノ)-4-オキソ-4-(2-ピリジニルチオ)ブタン酸tert-ブチル
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: C28H28N2O5S
Molecular formula furigana: C28-H28-N2-O5-S
Molecular weight: 504.600
InChI: InChI=1S/C28H28N2O5S/c1-28(2,3)35-25(31)16-23(26(32)36-24-14-8-9-15-29-24)30-27(33)34-17-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h4-15,22-23H,16-17H2,1-3H3,(H,30,33)/t23-/m0/s1
InChI key: VQDGFKKETACVMI-QHCPKHFHSA-N
SMILES: CC(C)(C)OC(=O)C[C@H](NC(=O)OCC1c2ccccc2c2ccccc12)C(=O)Sc1ccccn1
Systematic name  (3):
  • (3S)-3-(9H-フルオレン-9-イルメトキシカルボニルアミノ)-4-オキソ-4-(2-ピリジニルチオ)ブタン酸tert-ブチル
  • tert-ブチル (3S)-3-({[(9H-フルオレン-9-イル)メトキシ]カルボニル}アミノ)-4-オキソ-4-(ピリジン-2-イルスルファニル)ブタノアート
  • tert-butyl (3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-oxo-4-(pyridin-2-ylsulfanyl)butanoate
Other name (1):
  • (3S)-3-(9H-Fluorene-9-ylmethoxycarbonylamino)-4-oxo-4-(2-pyridinylthio)butanoic acid tert-butyl ester
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