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Potassium Cation → 6-[4-Chloro-1-[2-[4-(4-chloro-3-ethoxyphenyl)-2-methylpiperazin-1-yl]-2-oxoethyl]-5-methylpyrazol-3-yl]pyridine-2-carbonitrile

HRID 307272
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HRID 307272 반응식
[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Cl:16][CH2:17][C:18](=[O:19])[N:20]1[CH:21]([CH3:36])[CH2:22][N:23]([c:26]2[cH:27][c:28]([O:33][CH2:34][CH3:35])[c:29]([Cl:32])[cH:30][cH:31]2)[CH2:24][CH2:25]1.[Cl:1][c:2]1[c:3](-[c:8]2[n:9][c:10]([C:14]#[N:15])[cH:11][cH:12][cH:13]2)[n:4][nH:5][c:6]1[CH3:7].[K+:41].[K+:42]>>[Cl:1][c:2]1[c:3](-[c:8]2[n:9][c:10]([C:14]#[N:15])[cH:11][cH:12][cH:13]2)[n:4][n:5]([CH2:17][C:18](=[O:19])[N:20]2[CH:21]([CH3:36])[CH2:22][N:23]([c:26]3[cH:27][c:28]([O:33][CH2:34][CH3:35])[c:29]([Cl:32])[cH:30][cH:31]3)[CH2:24][CH2:25]2)[c:6]1[CH3:7]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 578401826-(4-chloro-5-methyl-1H-pyrazol-3-yl)pyridine-2-carbonitrileHCID 686530002-Chloro-1-[4-(4-chloro-3-ethoxyphenyl)-2-methylpiperazin-1-yl]ethanone

생성물 1

HCID 68652214
6-[4-Chloro-1-[2-[4-(4-chloro-3-ethoxyphenyl)-2-methylpiperazin-1-yl]-2-oxoethyl]-5-methylpyrazol-3-yl]pyridine-2-carbonitrile

출처 및 근거

ORD 기록
ord-16a63bf158b64dbaad95484626c4df07
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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