Chloroacetyl chloride → 2-chloro-N-methyl-N-[4-(1,3,3-trimethyl-6-aza-bicyclo[3.2.1]octane-6-carbonyl)-phenyl]-acetamide

반응식

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

참가 물질

반응물 3

HCID 6577Chloroacetyl chloride

HCID 8028Tetrahydrofuran

HCID 11414957(4-Methylamino-phenyl)-(1,3,3-trimethyl-6-aza-bicyclo[3.2.1]oct-6-yl)-methanone

생성물 1

HCID 684324252-chloro-N-methyl-N-[4-(1,3,3-trimethyl-6-aza-bicyclo[3.2.1]octane-6-carbonyl)-phenyl]-acetamide

출처 및 근거

ORD 기록: ord-7de9dd14f75647b8bef0d9ded0a254bd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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