Dichloromethane → 6-(2-tert-butylphenoxy)-5-isothiocyanato-N-methylpyridin-2-amine

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 11412697Thiocarbonyl diimidazole

HCID 598573486-(2-tert-Butylphenoxy)-N2-methylpyridine-2,5-diamine

생성물 1

HCID 598574466-(2-tert-butylphenoxy)-5-isothiocyanato-N-methylpyridin-2-amine

출처 및 근거

ORD 기록: ord-90d0066c282142ad9f1f8796bfd0a0d0
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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