N-(2-cyano-ethyl)-N-methyl-2-piperazin-1-yl-acetamide → HCID 178466520, 화합물

HRID 696409

반응식

HRID 696409 반응식
[C:38](#[N:39])[CH2:40][CH2:41][N:42]([C:43]([CH2:44][N:45]1[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]1)=[O:51])[CH3:52].[Cl:1][c:2]1[c:3]([C:33]([CH3:34])([CH3:35])[C:36]#[N:37])[cH:4][c:5]([O:30][CH2:31][CH3:32])[c:6]([C:8]2=[N:12][CH:11]([c:13]3[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]3)[CH:10]([c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[N:9]2[C:27](=[O:28])[Cl:29])[cH:7]1>>[Cl:1][c:2]1[c:3]([C:33]([CH3:34])([CH3:35])[C:36]#[N:37])[cH:4][c:5]([O:30][CH2:31][CH3:32])[c:6]([C:8]2=[N:12][CH:11]([c:13]3[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]3)[CH:10]([c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[N:9]2[C:27](=[O:28])[N:48]2[CH2:47][CH2:46][N:45]([CH2:44][C:43]([N:42]([CH2:41][CH2:40][C:38]#[N:39])[CH3:52])=[O:51])[CH2:50][CH2:49]2)[cH:7]1

참가 물질

3

반응물 2

HCID 28881147N-(2-cyano-ethyl)-N-methyl-2-piperazin-1-yl-acetamideHCID 877533322-[5-Chloro-4-(2-cyanopropan-2-yl)-2-ethoxyphenyl]-4,5-bis(4-chlorophenyl)-4,5-dihydroimidazole-1-carbonyl chloride

생성물 1

HCID 178466520HCID 178466520, 화합물

출처 및 근거

ORD 기록
ord-6fbde3c1d0ce4c429209f570c35cb69c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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