Chloroform → [4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-(2-methoxyethyl)-N-methylamine

반응식

[Br:7][c:8]1[n:9](-[c:25]2[c:26]([Br:31])[cH:27][cH:28][cH:29][cH:30]2)[c:10](-[c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[n:17][cH:18]2)[n:11][n:12]1.[CH3:1][O:2][CH2:3][CH2:4][NH:5][CH3:6].[CH:32]([Cl:33])([Cl:34])[Cl:35]>>[CH3:1][O:2][CH2:3][CH2:4][N:5]([CH3:6])[c:8]1[n:9](-[c:25]2[c:26]([Br:31])[cH:27][cH:28][cH:29][cH:30]2)[c:10](-[c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[n:17][cH:18]2)[n:11][n:12]1

참가 물질

반응물 3

HCID 6212Chloroform

HCID 300977(2-Methoxyethyl)(methyl)amine

HCID 220192295-[5-bromo-4-(2-bromophenyl)-4H-1,2,4-triazol-3-yl]-2-phenylpyridine

생성물 1

HCID 22019250[4-(2-Bromophenyl)-5-(6-phenylpyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-(2-methoxyethyl)-N-methylamine

출처 및 근거

ORD 기록: ord-3e11a3e7409942ce9763fa9b5bc3f639
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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