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Tetrahydrofuran → (5-(4-(Bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)(4-(methylsulfonyl)piperazin-1-yl)methanone

HRID 204150
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HRID 204150 반응식
[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[c:17]([NH:24][c:25]4[cH:26][n:27][c:28]([O:31][CH3:32])[cH:29][cH:30]4)[n:18][cH:19][c:20]([CH:21]=[O:22])[cH:23]3)[n:12][c:13]([CH3:15])[n:14]2)[CH2:33][c:34]2[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]2)[cH:42][cH:43]1.[CH3:47][S:48](=[O:49])(=[O:50])[N:51]1[CH2:52][CH2:53][NH:54][CH2:55][CH2:56]1.[Na:44][C:45]#[N:46]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[c:17]([NH:24][c:25]4[cH:26][n:27][c:28]([O:31][CH3:32])[cH:29][cH:30]4)[n:18][cH:19][c:20]([C:21](=[O:22])[N:54]4[CH2:53][CH2:52][N:51]([S:48]([CH3:47])(=[O:49])=[O:50])[CH2:56][CH2:55]4)[cH:23]3)[n:12][c:13]([CH3:15])[n:14]2)[CH2:33][c:34]2[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]2)[cH:42][cH:43]1
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참가 물질

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반응물 4

HCID 8028TetrahydrofuranHCID 7091611-(Methylsulfonyl)piperazineHCID 601552675-(4-(Bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)nicotinaldehydeHCID 178511850HCID 178511850, 화합물

생성물 1

HCID 66611409(5-(4-(Bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)(4-(methylsulfonyl)piperazin-1-yl)methanone

출처 및 근거

ORD 기록
ord-1f18e40614514b6498164e389ae9b8ca
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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