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Potassium Cation → 3,6-Dichloro-2-[(6-chloropyridin-3-ylthio)(pyridin-4-yl)methyl]pyridine

HRID 178945
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HRID 178945 반응식
[C:37](=[O:38])([O-:39])[O-:40].[CH3:17][CH2:18][N:19]([CH2:20][CH3:21])[CH2:22][CH3:23].[CH3:24][S:25](=[O:26])(=[O:27])[Cl:28].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[Cl:1][c:2]1[c:3]([CH:9]([OH:10])[c:11]2[cH:12][cH:13][n:14][cH:15][cH:16]2)[n:4][c:5]([Cl:8])[cH:6][cH:7]1.[Cl:29][c:30]1[cH:31][cH:32][c:33]([SH:36])[cH:34][n:35]1.[Cl:54][CH2:55][Cl:56].[K+:41].[K+:42]>>[Cl:1][c:2]1[c:3]([CH:9]([c:11]2[cH:12][cH:13][n:14][cH:15][cH:16]2)[S:36][c:33]2[cH:32][cH:31][c:30]([Cl:29])[n:35][cH:34]2)[n:4][c:5]([Cl:8])[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 31297Methanesulfonyl chloride
HCID 1415878
6-Chloropyridine-3-thiol
HCID 23028600(3,6-Dichloropyridin-2-yl) (pyridine-4-yl)methanol

생성물 1

HCID 231147773,6-Dichloro-2-[(6-chloropyridin-3-ylthio)(pyridin-4-yl)methyl]pyridine

출처 및 근거

ORD 기록
ord-94a3d3f3d9094eb9ae21b949576f31a1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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