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Dimethylformamide → tert-Butyl 4-(ethyl((tetrahydrofuran-2-yl)methyl)amino)-2-(4-(2-methyl-1H-imidazol-1-yl)phenylamino)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate

HRID 154518
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HRID 154518 반응식
[CH3:1][c:2]1[n:3](-[c:7]2[cH:8][cH:9][c:10]([NH:13][c:14]3[n:15][c:16]([O:31][S:32]([C:33]([F:34])([F:35])[F:36])(=[O:37])=[O:38])[c:17]4[c:18]([n:19]3)[CH2:20][CH2:21][N:22]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:23]4)[cH:11][cH:12]2)[cH:4][cH:5][n:6]1.[O:39]1[CH:40]([CH2:44][NH:45][CH2:46][CH3:47])[CH2:41][CH2:42][CH2:43]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[CH3:1][c:2]1[n:3](-[c:7]2[cH:8][cH:9][c:10]([NH:13][c:14]3[n:15][c:16]([N:45]([CH2:44][CH:40]4[O:39][CH2:43][CH2:42][CH2:41]4)[CH2:46][CH3:47])[c:17]4[c:18]([n:19]3)[CH2:20][CH2:21][N:22]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:23]4)[cH:11][cH:12]2)[cH:4][cH:5][n:6]1
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참가 물질

4

반응물 3

HCID 6228DimethylformamideHCID 98295N-EthyltetrahydrofurfurylamineHCID 59333780tert-Butyl 2-(4-(2-methyl-1H-imidazol-1-yl)phenylamino)-4-(trifluoromethylsulfonyloxy)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate

생성물 1

HCID 59333772tert-Butyl 4-(ethyl((tetrahydrofuran-2-yl)methyl)amino)-2-(4-(2-methyl-1H-imidazol-1-yl)phenylamino)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate

출처 및 근거

ORD 기록
ord-3ac45362e8a546299cfcf65ab21c177e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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