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Carbonate Ion → 7-(2-Fluorophenyl)-4-methyl-2-(2-methyl-2H-[1,2,4]triazol-3-ylmethoxy)-3-(thien-3-yl)pyrazolo[1,5-d][1,2,4]triazine

HRID 942221
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HRID 942221 반응식
[Br:1][c:2]1[c:3]([O:19][CH2:20][c:21]2[n:22]([CH3:26])[n:23][cH:24][n:25]2)[n:4][n:5]2[c:6](-[c:12]3[c:13]([F:18])[cH:14][cH:15][cH:16][cH:17]3)[n:7][n:8][c:9]([CH3:11])[c:10]12.[C:35](=[O:36])([O-:37])[O-:38].[C:41]([P:42]([C:43]([CH3:44])([CH3:45])[CH3:46])[C:47]([CH3:48])([CH3:49])[CH3:50])([CH3:51])([CH3:52])[CH3:53].[CH2:54]1[O:55][CH2:56][CH2:57][O:58][CH2:59]1.[Cs+:39].[Cs+:40].[O:62]=[C:63]([CH:64]=[CH:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)[CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[O:80]=[C:81]([CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1)[CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1.[O:98]=[C:99]([CH:100]=[CH:101][c:102]1[cH:103][cH:104][cH:105][cH:106][cH:107]1)[CH:108]=[CH:109][c:110]1[cH:111][cH:112][cH:113][cH:114][cH:115]1.[Pd:60].[Pd:61].[s:27]1[cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1>>[c:2]1(-[c:29]2[cH:28][s:27][cH:31][cH:30]2)[c:3]([O:19][CH2:20][c:21]2[n:22]([CH3:26])[n:23][cH:24][n:25]2)[n:4][n:5]2[c:6](-[c:12]3[c:13]([F:18])[cH:14][cH:15][cH:16][cH:17]3)[n:7][n:8][c:9]([CH3:11])[c:10]12
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 19660Carbonate IonHCID 23938Palladium2회HCID 312751,4-DioxaneHCID 83681Tris(1,1-dimethylethyl)phosphineHCID 95417Dibenzylidene acetone3회HCID 104967Cesium cation2회HCID 581760Thiophene-3-boronic acid
HCID 22506892
3-bromo-7-(2-fluorophenyl)-4-methyl-2-(2-methyl-2H-[1,2,4]triazol-3-ylmethoxy)pyrazolo[1,5-d][1,2,4]triazine

생성물 1

HCID 101804997-(2-Fluorophenyl)-4-methyl-2-(2-methyl-2H-[1,2,4]triazol-3-ylmethoxy)-3-(thien-3-yl)pyrazolo[1,5-d][1,2,4]triazine

출처 및 근거

ORD 기록
ord-2956917b585e404f90f6e00ee3e9f2cc
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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