Hydrochloric Acid → HCID 67442096, 화합물

HRID 189045노트

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HRID 189045 반응식
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH:40]([OH:41])([CH3:42])[CH3:43].[Cl:1][c:2]1[n:3][c:4]([CH3:11])[cH:5][c:6]([N:8]([CH3:9])[CH3:10])[n:7]1.[ClH:12].[NH2:13][CH:14]1[CH2:15][N:16]([C:19]([CH2:20][c:21]2[cH:22][cH:23][c:24]([O:27][C:28]([F:29])([F:30])[F:31])[cH:25][cH:26]2)=[O:32])[CH2:17][CH2:18]1>>[c:2]1([NH:13][CH:14]2[CH2:15][N:16]([C:19]([CH2:20][c:21]3[cH:22][cH:23][c:24]([O:27][C:28]([F:29])([F:30])[F:31])[cH:25][cH:26]3)=[O:32])[CH2:17][CH2:18]2)[n:3][c:4]([CH3:11])[cH:5][c:6]([N:8]([CH3:9])[CH3:10])[n:7]1

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 3776IsopropanolHCID 8471TriethylamineHCID 10813CrimidineHCID 674442381-(3-Aminopyrrolidin-1-yl)-2-[4-(trifluoromethoxy)phenyl]ethanone

생성물 1

HCID 67442096HCID 67442096, 화합물

출처 및 근거

ORD 기록
ord-8995e3c9b43540ddac10a4c58c303ad6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

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