Acetic Acid → HCID 25121373, 화합물

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[C:29]([CH3:30])([OH:31])=[O:32].[NH2:1][c:2]1[n:3][nH:4][c:5]2[cH:6][cH:7][c:8](-[c:11]3[n:12][c:13](=[O:28])[nH:14][c:15](-[c:17]4[c:18]([O:23][CH2:24][CH:25]([CH3:26])[CH3:27])[cH:19][cH:20][cH:21][cH:22]4)[cH:16]3)[cH:9][c:10]12.[O:33]=[CH:34][N:35]([CH3:36])[CH3:37]>>[NH:1]([c:2]1[n:3][nH:4][c:5]2[cH:6][cH:7][c:8](-[c:11]3[n:12][c:13](=[O:28])[nH:14][c:15](-[c:17]4[c:18]([O:23][CH2:24][CH:25]([CH3:26])[CH3:27])[cH:19][cH:20][cH:21][cH:22]4)[cH:16]3)[cH:9][c:10]12)[CH2:34][CH2:29][CH3:30]

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 6228Dimethylformamide

HCID 251213724-(3-amino-1H-indazol-5-yl)-6-(2-isobutoxyphenyl)pyrimidin-2(1H)-one

생성물 1

HCID 25121373HCID 25121373, 화합물

출처 및 근거

ORD 기록: ord-16c6c332f70a45a98fb1f8a918e6e69d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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