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Triethylamine → tert-butyl 2-[2-(3 {[tert-butyl(dimethyl)silyl]oxy}phenyl)-4-(5-chloro-2-fluorophenyl)-2,5-dihydro-1H-pyrrol-1-yl]-1,1-dimethyl-2-oxoethylcarbamate

HRID 172446
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HRID 172446 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][c:7]1[cH:8][c:9]([CH:13]2[N:14]([C:26]([O:27][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:32])[CH2:15][C:16]([c:18]3[c:19]([F:25])[cH:20][cH:21][c:22]([Cl:24])[cH:23]3)=[CH:17]2)[cH:10][cH:11][cH:12]1)([CH3:33])[CH3:34].[C:42]([CH3:43])([CH3:44])([CH3:45])[O:46][C:47](=[O:48])[NH:49][C:50]([C:51](=[O:52])[OH:53])([CH3:54])[CH3:55].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:56][C:57]([O:58][I:59]1([O:69][C:70]([CH3:71])=[O:72])([O:73][C:74]([CH3:75])=[O:76])[c:60]2[c:61]([cH:62][cH:63][cH:64][cH:65]2)[C:66](=[O:67])[O:68]1)=[O:77]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][c:7]1[cH:8][c:9]([CH:13]2[N:14]([C:51]([C:50]([NH:49][C:47]([O:46][C:42]([CH3:43])([CH3:44])[CH3:45])=[O:48])([CH3:54])[CH3:55])=[O:52])[CH2:15][C:16]([c:18]3[c:19]([F:25])[cH:20][cH:21][c:22]([Cl:24])[cH:23]3)=[CH:17]2)[cH:10][cH:11][cH:12]1)([CH3:33])[CH3:34]
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참가 물질

5

반응물 4

HCID 8471TriethylamineHCID 159087TriacetoxyperiodinaneHCID 2733845N-((1,1-dimethylethoxy)carbonyl)-2-methyl-alanineHCID 59682334tert-butyl 2-(3-{[tert-butyl(dimethyl)silyl]oxy)phenyl)-4-(5-chloro-2-fluorophenyl)-2,5-dihydro-1H-pyrrole-1-carboxylate

생성물 1

HCID 59656598
tert-butyl 2-[2-(3 {[tert-butyl(dimethyl)silyl]oxy}phenyl)-4-(5-chloro-2-fluorophenyl)-2,5-dihydro-1H-pyrrol-1-yl]-1,1-dimethyl-2-oxoethylcarbamate

출처 및 근거

ORD 기록
ord-88743474e76a4881a549e54268310465
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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