Ethanol → HCID 178457529, 화합물

HRID 115523

반응식

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

참가 물질

반응물 3

HCID 702Ethanol

HCID 6363Isopropylamine

HCID 178510531HCID 178510531, 화합물

생성물 1

HCID 178457529HCID 178457529, 화합물

출처 및 근거

ORD 기록: ord-24216756a4bd48fda4ef70cc66a18956
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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