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Dimethylformamide → 1-Benzo[1,3]dioxol-5-yl-2-[5-(3,4-dimethoxy-phenyl)-pyrimidin-2-yl]-2,3,4,9-tetrahydro-1H-beta-carboline

HRID 170296
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HRID 170296 반응식
[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH:10]3[NH:11][CH2:12][CH2:13][c:14]4[c:15]5[cH:16][cH:17][cH:18][cH:19][c:20]5[nH:21][c:22]43)[cH:6][cH:7][c:8]2[O:9]1.[Cl:23][c:24]1[n:25][cH:26][c:27](-[c:30]2[cH:31][c:32]([O:38][CH3:39])[c:33]([O:36][CH3:37])[cH:34][cH:35]2)[cH:28][n:29]1.[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH:10]3[N:11]([c:24]4[n:25][cH:26][c:27](-[c:30]5[cH:31][c:32]([O:38][CH3:39])[c:33]([O:36][CH3:37])[cH:34][cH:35]5)[cH:28][n:29]4)[CH2:12][CH2:13][c:14]4[c:15]5[cH:16][cH:17][cH:18][cH:19][c:20]5[nH:21][c:22]43)[cH:6][cH:7][c:8]2[O:9]1
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반응물 3

HCID 6228DimethylformamideHCID 2011721-(1,3-benzodioxol-5-yl)-2,3,4,9-tetrahydro-1H-beta-carbolineHCID 34869892-Chloro-5-(3,4-dimethoxyphenyl)pyrimidine

생성물 1

HCID 110494301-Benzo[1,3]dioxol-5-yl-2-[5-(3,4-dimethoxy-phenyl)-pyrimidin-2-yl]-2,3,4,9-tetrahydro-1H-beta-carboline

출처 및 근거

ORD 기록
ord-5573e5f28b084a5f830272ab17c6c887
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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