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Sodium Ion → N-(4-(3-(2-methylpyridin-4-yl)pyrazin-2-yloxy)phenyl)benzo[d]thiazol-2-amine

HRID 126005
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HRID 126005 반응식
[CH2:41]1[O:42][CH2:43][CH2:44][O:45][CH2:46]1.[CH3:25][c:26]1[n:27][cH:28][cH:29][c:30]([B:32]([OH:33])[OH:34])[cH:31]1.[Cl:1][c:2]1[c:3]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:15][c:16]3[s:17][c:18]4[c:19]([n:20]3)[cH:21][cH:22][cH:23][cH:24]4)[cH:13][cH:14]2)[n:4][cH:5][cH:6][n:7]1.[Na+:35].[Na+:36].[O-:37][C:38](=[O:39])[O-:40].[OH2:47]>>[c:2]1(-[c:30]2[cH:29][cH:28][n:27][c:26]([CH3:25])[cH:31]2)[c:3]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:15][c:16]3[s:17][c:18]4[c:19]([n:20]3)[cH:21][cH:22][cH:23][cH:24]4)[cH:13][cH:14]2)[n:4][cH:5][cH:6][n:7]1
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반응물 6

HCID 923Sodium Ion2회HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 41926642-Methylpyridine-4-boronic acidHCID 59351351N-(4-(3-chloropyrazin-2-yloxy)phenyl)benzo[d]thiazol-2-amine

생성물 1

HCID 59351437
N-(4-(3-(2-methylpyridin-4-yl)pyrazin-2-yloxy)phenyl)benzo[d]thiazol-2-amine

출처 및 근거

ORD 기록
ord-16bbc2e1897b4a738e53ad1a91dc2522
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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