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Tetrahydrofuran → N-(2,6-difluorophenyl)-3-[3-(2-{[2-methyl-4-({1-[2-(methylsulfonyl)ethyl]-4-piperidinyl}oxy)phenyl]amino}-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]benzamide

HRID 115239
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인쇄 미리보기

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HRID 115239 반응식
[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[CH:48](=[CH2:49])[S:50](=[O:51])(=[O:52])[CH3:53].[F:1][c:2]1[c:3]([NH:9][C:10]([c:11]2[cH:12][c:13](-[c:17]3[n:18][c:19]4[n:20]([cH:21][cH:22][cH:23][cH:24]4)[c:25]3-[c:26]3[n:27][c:28]([NH:32][c:33]4[c:34]([CH3:46])[cH:35][c:36]([O:39][CH:40]5[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]5)[cH:37][cH:38]4)[n:29][cH:30][cH:31]3)[cH:14][cH:15][cH:16]2)=[O:47])[c:4]([F:8])[cH:5][cH:6][cH:7]1>>[F:1][c:2]1[c:3]([NH:9][C:10]([c:11]2[cH:12][c:13](-[c:17]3[n:18][c:19]4[n:20]([cH:21][cH:22][cH:23][cH:24]4)[c:25]3-[c:26]3[n:27][c:28]([NH:32][c:33]4[c:34]([CH3:46])[cH:35][c:36]([O:39][CH:40]5[CH2:41][CH2:42][N:43]([CH2:49][CH2:48][S:50](=[O:51])(=[O:52])[CH3:53])[CH2:44][CH2:45]5)[cH:37][cH:38]4)[n:29][cH:30][cH:31]3)[cH:14][cH:15][cH:16]2)=[O:47])[c:4]([F:8])[cH:5][cH:6][cH:7]1
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참가 물질

4

반응물 3

HCID 8028TetrahydrofuranHCID 19354Methyl vinyl sulfoneHCID 59452825N-(2,6-difluorophenyl)-3-[3-(2-{[2-methyl-4-(4-piperidinyloxy)phenyl]-amino}-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]benzamide

생성물 1

HCID 59452726N-(2,6-difluorophenyl)-3-[3-(2-{[2-methyl-4-({1-[2-(methylsulfonyl)ethyl]-4-piperidinyl}oxy)phenyl]amino}-4-pyrimidinyl)imidazo[1,2-a]pyridin-2-yl]benzamide

출처 및 근거

ORD 기록
ord-07083cd8266b493e9e3c39a13431cb1b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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