Piperazine → HCID 178466264, 화합물

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:34][CH2:35][CH3:36])[c:8]([C:11]2=[N:15][C:14]([CH3:16])([c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[CH:13]([c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[N:12]2[C:31](=[O:32])[Cl:33])[cH:9][cH:10]1.[CH2:37]1[CH2:38][NH:39][CH2:40][CH2:41][NH:42]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:34][CH2:35][CH3:36])[c:8]([C:11]2=[N:15][C:14]([CH3:16])([c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[CH:13]([c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[N:12]2[C:31](=[O:32])[N:39]2[CH2:38][CH2:37][NH:42][CH2:41][CH2:40]2)[cH:9][cH:10]1

참가 물질

반응물 2

HCID 4837Piperazine

HCID 72455720rac-(4S*,5R*)-2-(4-tert-Butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4-methyl-4,5-dihydro-imidazole-1-carbonyl chloride

생성물 1

HCID 178466264HCID 178466264, 화합물

출처 및 근거

ORD 기록: ord-4ac38036e8c2435da68fd81945ffd6c1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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