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Dimethylformamide → N-cyclobutyl-2-[[3-(2-pyridin-2-ylethenyl)-1H-indazol-6-yl]amino]benzamide

HRID 97432
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HRID 97432 반응식
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH:28]1([NH2:32])[CH2:29][CH2:30][CH2:31]1.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[n:1]1[c:2]([CH:7]=[CH:8][c:9]2[n:10][nH:11][c:12]3[cH:13][c:14]([NH:18][c:19]4[c:20]([C:21](=[O:22])[OH:23])[cH:24][cH:25][cH:26][cH:27]4)[cH:15][cH:16][c:17]23)[cH:3][cH:4][cH:5][cH:6]1.[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[n:1]1[c:2]([CH:7]=[CH:8][c:9]2[n:10][nH:11][c:12]3[cH:13][c:14]([NH:18][c:19]4[c:20]([C:21](=[O:23])[NH:32][CH:28]5[CH2:29][CH2:30][CH2:31]5)[cH:24][cH:25][cH:26][cH:27]4)[cH:15][cH:16][c:17]23)[cH:3][cH:4][cH:5][cH:6]1
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참가 물질

7

반응물 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 75645CyclobutylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 693529632-[3-(2-Pyridin-2-yl-vinyl)-1H-indazol-6-ylamino]-benzoic acid

생성물 1

HCID 69353118
N-cyclobutyl-2-[[3-(2-pyridin-2-ylethenyl)-1H-indazol-6-yl]amino]benzamide

출처 및 근거

ORD 기록
ord-26c1d24f85644e2390d1ec0b88ed77be
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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