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Chloride → 5-Chloro-N-{2-[(2-hydroxyethyl)phenylamino]-2-oxoethyl}-1H-indole-2-carboxamide

HRID 697273
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반응식

HRID 697273 반응식
[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:29][O:30][c:31]1[n:32][c:33]([O:34][CH3:35])[n:36][c:37]([N+:38]2([CH3:39])[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[n:45]1.[Cl-:28].[Cl:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:11](=[O:12])[NH:13][CH2:14][C:15](=[O:16])[OH:17])[nH:7][c:8]2[cH:9][cH:10]1.[OH2:46].[c:18]1([NH:24][CH2:25][CH2:26][OH:27])[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[Cl:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:11](=[O:12])[NH:13][CH2:14][C:15](=[O:17])[N:24]([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[CH2:25][CH2:26][OH:27])[nH:7][c:8]2[cH:9][cH:10]1
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반응물 6

HCID 312ChlorideHCID 962WaterHCID 8028TetrahydrofuranHCID 31235N-(2-Hydroxyethyl)anilineHCID 27340604-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholin-4-iumHCID 11436686N-[(5-chloro-1H-indol-2-yl)carbonyl]glycine

생성물 1

HCID 10237241
5-Chloro-N-{2-[(2-hydroxyethyl)phenylamino]-2-oxoethyl}-1H-indole-2-carboxamide

출처 및 근거

ORD 기록
ord-c88eeff757b7425ea4bff92b444d58a0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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