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Potassium Cation → 5-[3-({1-[2-(2-Chloroethoxy)phenyl]cyclopropyl}amino)-2-oxopyrazin-1(2H)-yl]-N-cyclopropyl-2-fluoro-4-methylbenzamide

HRID 1219650
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HRID 1219650 반응식
[C:33](=[O:34])([O-:35])[O-:36].[CH3:43][C:44]#[N:45].[CH:1]1([NH:4][C:5]([c:6]2[c:7]([F:31])[cH:8][c:9]([CH3:30])[c:10](-[n:12]3[c:13](=[O:29])[c:14]([NH:18][C:19]4([c:22]5[c:23]([OH:28])[cH:24][cH:25][cH:26][cH:27]5)[CH2:20][CH2:21]4)[n:15][cH:16][cH:17]3)[cH:11]2)=[O:32])[CH2:2][CH2:3]1.[Cl:39][CH2:40][CH2:41][Br:42].[K+:37].[K+:38]>>[CH:1]1([NH:4][C:5]([c:6]2[c:7]([F:31])[cH:8][c:9]([CH3:30])[c:10](-[n:12]3[c:13](=[O:29])[c:14]([NH:18][C:19]4([c:22]5[c:23]([O:28][CH2:41][CH2:40][Cl:39])[cH:24][cH:25][cH:26][cH:27]5)[CH2:20][CH2:21]4)[n:15][cH:16][cH:17]3)[cH:11]2)=[O:32])[CH2:2][CH2:3]1
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반응물 5

HCID 813Potassium Cation2회HCID 6342AcetonitrileHCID 78491-Bromo-2-ChloroethaneHCID 19660Carbonate IonHCID 66689387N-Cyclopropyl-2-fluoro-5-[3-{[1-(2-hydroxyphenyl)cyclopropyl]amino}-2-oxopyrazin-1(2H)-yl]-4-methylbenzamide

생성물 1

HCID 66689220
5-[3-({1-[2-(2-Chloroethoxy)phenyl]cyclopropyl}amino)-2-oxopyrazin-1(2H)-yl]-N-cyclopropyl-2-fluoro-4-methylbenzamide

출처 및 근거

ORD 기록
ord-eaf0c8dfbbdb46c8bbf86a6d9ef3784d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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