Acetic Acid → HCID 57675113, 화합물

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

참가 물질

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HCID 176Acetic Acid

HCID 31976483-(4-Methylpiperazine-1-sulfonyl)aniline

HCID 43021752-Chloro-5-methylpyrimidin-4-amine

생성물 1

HCID 57675113HCID 57675113, 화합물

출처 및 근거

ORD 기록: ord-10a4f933ed7f4c00b9c47be518832101
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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