Methanol → N-[1-amino-3-[2-(trifluoromethyl)phenyl]propan-2-yl]-4-(4-chloro-1-ethylpyrazol-5-yl)thiophene-2-carboxamide

반응식

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

참가 물질

반응물 2

HCID 887Methanol

HCID 1784630944-(4-chloro-1-ethylpyrazol-5-yl)-N-[1-(1,3-dioxoisoindol-2-yl)-3-[2-(trifluoromethyl)phenyl]propan-2-yl]thiophene-2-carboxamide

생성물 1

HCID 76576428N-[1-amino-3-[2-(trifluoromethyl)phenyl]propan-2-yl]-4-(4-chloro-1-ethylpyrazol-5-yl)thiophene-2-carboxamide

출처 및 근거

ORD 기록: ord-df4386b9f9694770a59ebe5d44eba6cd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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