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Potassium Cation → ethyl 5-(1-(4-fluorobenzyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-3-methylthiophene-2-carboxylate

HRID 666793
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HRID 666793 반응식
[C:18](=[O:19])([O-:20])[O-:21].[CH3:1][c:2]1[c:3]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[s:4][c:5](-[n:7]2[cH:8][n:9][nH:10][c:11]2=[O:12])[cH:6]1.[CH3:33][N:34]([CH3:35])[CH:36]=[O:37].[F:24][c:25]1[cH:26][cH:27][c:28]([CH2:29][Br:30])[cH:31][cH:32]1.[K+:22].[K+:23]>>[CH3:1][c:2]1[c:3]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[s:4][c:5](-[n:7]2[cH:8][n:9][n:10]([CH2:29][c:28]3[cH:27][cH:26][c:25]([F:24])[cH:32][cH:31]3)[c:11]2=[O:12])[cH:6]1
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반응물 5

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 680214-Fluorobenzyl bromideHCID 59481255ethyl 3-methyl-5-(5-oxo-1H-1,2,4-triazol-4(5H)-yl)thiophene-2-carboxylate

생성물 1

HCID 58031537ethyl 5-(1-(4-fluorobenzyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-3-methylthiophene-2-carboxylate

출처 및 근거

ORD 기록
ord-f40c4c8c48fb4d43b0d454313ef1c90b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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