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Dimethyl Sulfoxide → [1-[6-methyl-2-[4-(2-methylimidazol-1-yl)anilino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-2,3-dihydroindol-2-yl]methanol

HRID 1209895
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HRID 1209895 반응식
[CH3:44][S:45]([CH3:46])=[O:47].[F:12][C:13]([F:14])([F:15])[S:16]([O:17][c:18]1[c:19]2[c:20]([n:21][c:22]([NH:24][c:25]3[cH:26][cH:27][c:28](-[n:31]4[c:32]([CH3:36])[n:33][cH:34][cH:35]4)[cH:29][cH:30]3)[n:23]1)[CH2:37][CH2:38][N:39]([CH3:41])[CH2:40]2)(=[O:42])=[O:43].[NH:1]1[CH:2]([CH2:10][OH:11])[CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21>>[N:1]1([c:18]2[c:19]3[c:20]([n:21][c:22]([NH:24][c:25]4[cH:26][cH:27][c:28](-[n:31]5[c:32]([CH3:36])[n:33][cH:34][cH:35]5)[cH:29][cH:30]4)[n:23]2)[CH2:37][CH2:38][N:39]([CH3:41])[CH2:40]3)[CH:2]([CH2:10][OH:11])[CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21
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반응물 3

HCID 679Dimethyl SulfoxideHCID 27946642,3-dihydro-1H-indol-2-ylmethanolHCID 593337246-methyl-2-(4-(2-methyl-1H-imidazol-1-yl)phenylamino)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl trifluoromethanesulfonate

생성물 1

HCID 67423147[1-[6-methyl-2-[4-(2-methylimidazol-1-yl)anilino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-2,3-dihydroindol-2-yl]methanol

출처 및 근거

ORD 기록
ord-9879950ee21244a5ac4596859ca4059d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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