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Water → 2-amino-6-(3-methoxyprop-1-enyl)-N-[(5-phenoxythiophen-2-yl)methyl]pyridine-3-carboxamide

HRID 1124969
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HRID 1124969 반응식
[C:45](#[N:46])[CH3:47].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][c:8]2[s:9][c:10]([O:13][c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[cH:11][cH:12]2)[cH:20][cH:21][c:22]([C:24]#[C:25][CH2:26][O:27][CH3:28])[n:23]1.[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[OH2:44].[OH:48][C:49]([C:50]([F:51])([F:52])[F:53])=[O:54].[cH:34]1[cH:35][c:36]2[c:37]([n:38][cH:39][cH:40][cH:41]2)[cH:42][cH:43]1>>[NH2:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][c:8]2[s:9][c:10]([O:13][c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[cH:11][cH:12]2)[cH:20][cH:21][c:22]([CH:24]=[CH:25][CH2:26][O:27][CH3:28])[n:23]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 962WaterHCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 7047QuinolineHCID 8028TetrahydrofuranHCID 231307162-Amino-6-(3-methoxy-1-propynyl)-N-(5-phenoxy-thiophen-2-ylmethyl)-nicotinamide

생성물 1

HCID 67119554
2-amino-6-(3-methoxyprop-1-enyl)-N-[(5-phenoxythiophen-2-yl)methyl]pyridine-3-carboxamide

출처 및 근거

ORD 기록
ord-65d161fbdc4b4f52af31b319730c016a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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