Chem
J-GLOBAL ID:201907011212529043
Nikkaji number:J3.739.037B
tert-butyl (2'S,3S,4'S,5'S)-4'-(5-bromothiophen-2-yl)-2-oxo-2'-(pyridin-2-yl)-1H-spiro[indole-3,3'-pyrrolidine]-5'-carboxylate
tert-ブチル(2'S,3S,4'S,5'S)-4'-(5-ブロモチオフェン-2-イル)-2-オキソ-2'-(ピリジン-2-イル)-1H-スピロ[インドール-3,3'-ピロリジン]-5'-カルボキシラート
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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:
C25 H24 BrN3 O3 S
Molecular formula furigana:
C25-H24-BR-N3-O3-S
Molecular weight:
526.450
InChI:
InChI=1S/C25H24BrN3O3S/c1-24(2,3)32-22(30)20-19(17-11-12-18(26)33-17)25(21(29-20)16-10-6-7-13-27-16)14-8-4-5-9-15(14)28-23(25)31/h4-13,19-21,29H,1-3H3,(H,28,31)/t19-,20+,21-,25-/m1/s1
InChI key:
KHINNUDROCVJSM-FBROZUCGSA-N
SMILES:
C1(=O)[C@]2(c3ccccc3N1)[C@@H]([C@H](N[C@@H]2c1ncccc1)C(=O)OC(C)(C)C)c1sc(cc1)Br
Systematic name (3):
(2′S,3S,3′S,5′S)-2′-(tert-ブトキシカルボニル)-3′-(5-ブロモ-2-チエニル)-5′-(2-ピリジニル)スピロ[インドリン-3,4′-ピロリジン]-2-オン
tert-ブチル(2'S,3S,4'S,5'S)-4'-(5-ブロモチオフェン-2-イル)-2-オキソ-2'-(ピリジン-2-イル)-1,2-ジヒドロスピロ[インドール-3,3'-ピロリジン]-5'-カルボキシラート
tert-butyl (2'S,3S,4'S,5'S)-4'-(5-bromothiophen-2-yl)-2-oxo-2'-(pyridin-2-yl)-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate
Other name (2):
tert-ブチル(2'S,3S,4'S,5'S)-4'-(5-ブロモチオフェン-2-イル)-2-オキソ-2'-(ピリジン-2-イル)-1H-スピロ[インドール-3,3'-ピロリジン]-5'-カルボキシラート
tert-butyl (2'S,3S,4'S,5'S)-4'-(5-bromothiophen-2-yl)-2-oxo-2'-(pyridin-2-yl)-1H-spiro[indole-3,3'-pyrrolidine]-5'-carboxylate
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