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Hydrochloric Acid → 1-(2-methoxy-5-fluorobenzoyl)-3-(2-(4-(1-(2-ethoxyethyl)-1H-benzimidazol-2-yl-amino)piperidin-1-yl)ethyl)-3-phenylpyrrolidine

HRID 321628
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HRID 321628 반응식
[CH2:14]([CH3:15])[O:16][CH2:17][CH2:18][n:19]1[c:20]([NH:28][CH:29]2[CH2:30][CH2:31][N:32]([CH2:35][CH2:36][C:37]3([c:42]4[cH:43][cH:44][cH:45][cH:46][cH:47]4)[CH2:38][NH:39][CH2:40][CH2:41]3)[CH2:33][CH2:34]2)[n:21][c:22]2[c:23]1[cH:24][cH:25][cH:26][cH:27]2.[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[OH:7])[cH:8][c:9]([F:12])[cH:10][cH:11]1.[ClH:13]>>[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:7])[N:39]2[CH2:38][C:37]([CH2:36][CH2:35][N:32]3[CH2:31][CH2:30][CH:29]([NH:28][c:20]4[n:19]([CH2:18][CH2:17][O:16][CH2:14][CH3:15])[c:23]5[c:22]([n:21]4)[cH:27][cH:26][cH:25][cH:24]5)[CH2:34][CH2:33]3)([c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[CH2:41][CH2:40]2)[cH:8][c:9]([F:12])[cH:10][cH:11]1
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반응물 3

HCID 313Hydrochloric AcidHCID 27373645-Fluoro-2-methoxybenzoic acidHCID 220091003-(2-(4-(1-(2-Ethoxyethyl)-1H-benzimidazol-2-yl-amino)piperidin-1-yl)ethyl)-3-phenylpyrrolidine

생성물 1

HCID 206422651-(2-methoxy-5-fluorobenzoyl)-3-(2-(4-(1-(2-ethoxyethyl)-1H-benzimidazol-2-yl-amino)piperidin-1-yl)ethyl)-3-phenylpyrrolidine

출처 및 근거

ORD 기록
ord-f801460dd96d48888babcd1c1dd3a717
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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