Hydrochloric Acid → HCID 178466500, 화합물

HRID 2128281

반응식

HRID 2128281 반응식
[CH3:39][O:40][CH2:41][CH:42]([CH3:43])[NH:44][C:45]([CH2:46][N:47]1[CH2:48][CH2:49][NH:50][CH2:51][CH2:52]1)=[O:53].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[N:9]=[C:10]([c:23]3[c:24]([O:34][CH2:35][CH3:36])[cH:25][c:26]([C:29]([CH3:30])([CH3:31])[C:32]#[N:33])[cH:27][cH:28]3)[N:11]([C:20](=[O:21])[Cl:22])[CH:12]2[c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[cH:6][cH:7]1.[ClH:37].[ClH:38]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[N:9]=[C:10]([c:23]3[c:24]([O:34][CH2:35][CH3:36])[cH:25][c:26]([C:29]([CH3:30])([CH3:31])[C:32]#[N:33])[cH:27][cH:28]3)[N:11]([C:20](=[O:21])[N:50]3[CH2:49][CH2:48][N:47]([CH2:46][C:45]([NH:44][CH:42]([CH2:41][O:40][CH3:39])[CH3:43])=[O:53])[CH2:52][CH2:51]3)[CH:12]2[c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[cH:6][cH:7]1

참가 물질

4

반응물 3

HCID 313Hydrochloric Acid2회HCID 43130617N-(2-methoxy-1-methylethyl)-2-piperazin-1-yl-acetamideHCID 178466492HCID 178466492, 화합물

생성물 1

HCID 178466500HCID 178466500, 화합물

출처 및 근거

ORD 기록
ord-96cd19562a504e5eb7730f240b5b0235
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

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