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Dimethylformamide → 2-[4-[(1-hydroxy-3-phenylpropan-2-yl)amino]-2-oxo-1H-pyridin-3-yl]-7-methyl-3H-benzimidazole-5-carbonitrile

HRID 93468
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인쇄 미리보기

반응식

HRID 93468 반응식
[CH3:21][N:22]1[CH2:23][CH2:24][O:25][CH2:26][CH2:27]1.[Cl:1][c:2]1[c:3](-[c:9]2[nH:10][c:11]3[c:12]([n:13]2)[c:14]([CH3:20])[cH:15][c:16]([C:18]#[N:19])[cH:17]3)[c:4](=[O:8])[nH:5][cH:6][cH:7]1.[NH2:28][CH:29]([CH2:30][OH:31])[CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[O:39]=[CH:40][N:41]([CH3:42])[CH3:43]>>[c:2]1([NH:28][CH:29]([CH2:30][OH:31])[CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:3](-[c:9]2[nH:10][c:11]3[c:12]([n:13]2)[c:14]([CH3:20])[cH:15][c:16]([C:18]#[N:19])[cH:17]3)[c:4](=[O:8])[nH:5][cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 76652DL-PhenylalaninolHCID 1356816422-(4-Chloro-2-oxo-1,2-dihydro-pyridin-3-yl)-7-methyl-3H-benzimidazole-5-carbonitrile

생성물 1

HCID 1363846272-[4-[(1-hydroxy-3-phenylpropan-2-yl)amino]-2-oxo-1H-pyridin-3-yl]-7-methyl-3H-benzimidazole-5-carbonitrile

출처 및 근거

ORD 기록
ord-86e8723b3dbe4b5aa183384579bfa705
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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