Ethanol → HCID 49819421, 화합물

HRID 145303

반응식

HRID 145303 반응식
[CH3:36][CH2:37][OH:38].[Cl:1][c:2]1[n:3][o:4][c:5]([CH:7]2[CH2:8][N:9]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH2:10][CH:11]([c:13]3[cH:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[CH2:12]2)[n:6]1.[O:31]1[CH2:32][CH:33]([NH2:35])[CH2:34]1>>[c:2]1([NH:35][CH:33]2[CH2:32][O:31][CH2:34]2)[n:3][o:4][c:5]([CH:7]2[CH2:8][N:9]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH2:10][CH:11]([c:13]3[cH:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[CH2:12]2)[n:6]1

참가 물질

4

반응물 3

HCID 702EthanolHCID 98339233-OxetanamineHCID 58116540{3-(3-Chloro-1,2,4-oxadiazol-5-yl)-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl}(morpholin-4-yl)methanone

생성물 1

HCID 49819421HCID 49819421, 화합물

출처 및 근거

ORD 기록
ord-ceabe8c8d0584e51800cc43b8fd98233
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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