4-Methylpyrazole → [4-(2-Fluoro-4-trifluoromethyl-phenyl)-piperazin-1-yl]-[5-methanesulfonyl-2-(4-methyl-pyrazol-1-yl)-phenyl]-methanone

HRID 1206885노트

반응식

HRID 1206885 반응식
[CH3:31][c:32]1[cH:33][n:34][nH:35][cH:36]1.[F:1][c:2]1[c:3]([N:12]2[CH2:13][CH2:14][N:15]([C:18](=[O:19])[c:20]3[c:21]([I:30])[cH:22][cH:23][c:24]([S:26](=[O:27])(=[O:28])[CH3:29])[cH:25]3)[CH2:16][CH2:17]2)[cH:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1>>[F:1][c:2]1[c:3]([N:12]2[CH2:13][CH2:14][N:15]([C:18](=[O:19])[c:20]3[c:21](-[n:34]4[cH:33][c:32]([CH3:31])[cH:36][n:35]4)[cH:22][cH:23][c:24]([S:26](=[O:27])(=[O:28])[CH3:29])[cH:25]3)[CH2:16][CH2:17]2)[cH:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1

참가 물질

3

반응물 2

HCID 34064-MethylpyrazoleHCID 59793591[4-(2-Fluoro-4-trifluoromethyl-phenyl)piperazin-1-yl]-(2-iodo-5-methanesulfonyl-phenyl)-methanone

생성물 1

HCID 68844178[4-(2-Fluoro-4-trifluoromethyl-phenyl)-piperazin-1-yl]-[5-methanesulfonyl-2-(4-methyl-pyrazol-1-yl)-phenyl]-methanone

출처 및 근거

ORD 기록
ord-4c292b06bbc24ff7837b58ad80f93bf0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

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