Imidazole → 1-(2-Methoxyphenyl)-4-[1-(2,4-dimethylpyridin-3-yl)-cyclohex-1-en-4-yl]piperazine

반응식

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

참가 물질

반응물 3

HCID 795Imidazole

HCID 8028Tetrahydrofuran

HCID 199585441-(2-Methoxyphenyl)-4-[1-hydroxy-1-(2,4-dimethylpyridin-3-yl)-cyclohex-4-yl]piperazine

생성물 1

HCID 199585431-(2-Methoxyphenyl)-4-[1-(2,4-dimethylpyridin-3-yl)-cyclohex-1-en-4-yl]piperazine

출처 및 근거

ORD 기록: ord-7ffa26b81bf94bf09bf42ca9c94493ef
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…