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Chloride → 5-Chloro-7-(2,4-dichlorophenyl)-2-(1-methylpiperidin-4-yl)[1,2,4]triazolo[1,5-c]pyrimidine

HRID 1141242
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HRID 1141242 반응식
[C:26](=[O:27])([OH:28])[O-:29].[CH2:37]([N+:38]([CH2:39][CH3:40])([CH2:41][CH3:42])[CH2:43][CH3:44])[c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Cl-:36].[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[n:12]([c:13](=[O:15])[nH:14]2)[n:16][c:17]([CH:19]2[CH2:20][CH2:21][N:22]([CH3:25])[CH2:23][CH2:24]2)[n:18]3)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Na+:30].[P:31]([Cl:32])([Cl:33])([Cl:34])=[O:35]>>[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[n:12]([c:13]([Cl:33])[n:14]2)[n:16][c:17]([CH:19]2[CH2:20][CH2:21][N:22]([CH3:25])[CH2:23][CH2:24]2)[n:18]3)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1
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HCID 312ChlorideHCID 769Bicarbonate IonHCID 923Sodium IonHCID 17208BenzyltriethylammoniumHCID 24813Phosphorus oxychlorideHCID 1361041907-(2,4-Dichlorophenyl)-2-(1-methylpiperidin-4-yl)[1,2,4]triazolo[1,5-c]pyrimidin-5(6H)-one

생성물 1

HCID 58305982
5-Chloro-7-(2,4-dichlorophenyl)-2-(1-methylpiperidin-4-yl)[1,2,4]triazolo[1,5-c]pyrimidine

출처 및 근거

ORD 기록
ord-5e924ab3d83247a9bcc2f9c90c5f7bbd
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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