2,2,2-Trifluoroethyl trifluoromethanesulfonate → [5-[3-(3-Aza-bicyclo[3.1.0]hex-3-yl)-propoxy]-1-(2,2,2-trifluoro-ethyl)-1H-indol-2-yl]-morpholin-4-yl-methanone

HRID 104685

반응식

HRID 104685 반응식
[CH:24]12[CH2:25][N:26]([CH2:30][CH2:31][CH2:32][O:33][c:34]3[cH:35][c:36]4[c:37]([cH:38][cH:39]3)[nH:40][c:41]([C:42]([N:43]3[CH2:44][CH2:45][O:46][CH2:47][CH2:48]3)=[O:49])[cH:50]4)[CH2:27][CH:28]1[CH2:29]2.[F:51][C:52]([F:53])([F:54])[CH2:55][O:56][S:57]([C:58]([F:59])([F:60])[F:61])(=[O:62])=[O:63].[OH:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][O:21][CH2:22][CH2:23]3)[n:7]([CH2:11][C:12]([F:13])([F:14])[F:15])[c:8]2[cH:9][cH:10]1>>[O:1]([c:2]1[cH:3][c:4]2[cH:5][c:6]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][O:21][CH2:22][CH2:23]3)[n:7]([CH2:11][C:12]([F:13])([F:14])[F:15])[c:8]2[cH:9][cH:10]1)[CH2:32][CH2:31][CH2:30][N:26]1[CH2:25][CH:24]2[CH:28]([CH2:27]1)[CH2:29]2

참가 물질

4

반응물 3

HCID 803662,2,2-Trifluoroethyl trifluoromethanesulfonateHCID 16754253{5-[3-(3-Aza-bicyclo[3.1.0]hex-3-yl)-propoxy]-1H-indol-2-yl}-morpholin-4-yl-methanoneHCID 67527268[5-Hydroxy-1-(2,2,2-trifluoro-ethyl)-1H-indol-2-yl]-morpholin-4-yl-methanone

생성물 1

HCID 16112804[5-[3-(3-Aza-bicyclo[3.1.0]hex-3-yl)-propoxy]-1-(2,2,2-trifluoro-ethyl)-1H-indol-2-yl]-morpholin-4-yl-methanone

출처 및 근거

ORD 기록
ord-1ac437cb7aab4c9397743ce82386f787
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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