(1-Benzylpiperidin-2-yl)methanol → [4-(1-Benzyl-piperidine-2-ylmethoxy)-phenyl]-[6-methoxy-2-(4-methoxy-phenyl)-benzo[b]thiophen-3-yl]-methanone

HRID 680198노트

반응식

HRID 680198 반응식
[CH2:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[N:36]1[CH:37]([CH2:42][OH:43])[CH2:38][CH2:39][CH2:40][CH2:41]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([s:8][c:9](-[c:20]3[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]3)[c:10]2[C:11](=[O:12])[c:13]2[cH:14][cH:15][c:16]([OH:19])[cH:17][cH:18]2)[cH:28]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([s:8][c:9](-[c:20]3[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]3)[c:10]2[C:11](=[O:12])[c:13]2[cH:14][cH:15][c:16]([O:19][CH2:42][CH:37]3[N:36]([CH2:29][c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[CH2:41][CH2:40][CH2:39][CH2:38]3)[cH:17][cH:18]2)[cH:28]1

참가 물질

3

반응물 2

HCID 2735486(1-Benzylpiperidin-2-yl)methanolHCID 98651972-(4-Methoxyphenyl)-3-(4-Hydroxybenzoyl)-6-Methoxybenzo[b]thiophene

생성물 1

HCID 23512907[4-(1-Benzyl-piperidine-2-ylmethoxy)-phenyl]-[6-methoxy-2-(4-methoxy-phenyl)-benzo[b]thiophen-3-yl]-methanone

출처 및 근거

ORD 기록
ord-6d63a50a2a934c3aad22f1ba797caf4f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

반응 노트

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