Tetrahydrofuran → N-[(4,6-dimethylpyrimidin-2-yl)aminocarbonyl]-2,3-dihydro-2,2-dimethyl-7-benzofuransulfonamide

반응식

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

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 130212-Amino-4,6-dimethyl pyrimidine

HCID 134241822,2-Dimethyl-2,3-dihydro-1-benzofuran-7-sulfonyl isocyanate

생성물 1

HCID 13424183N-[(4,6-dimethylpyrimidin-2-yl)aminocarbonyl]-2,3-dihydro-2,2-dimethyl-7-benzofuransulfonamide

출처 및 근거

ORD 기록: ord-b381c2de416449088b5b232c527a5798
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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