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Chloroform → 4-(4-chloro-1-methylpyrazol-5-yl)-N-[1-(1,3-dioxoisoindol-2-yl)-3-[3-(trifluoromethyl)phenyl]propan-2-yl]-5-methoxythiophene-2-carboxamide

HRID 321746
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HRID 321746 반응식
[CH3:43][C:44]([O:45][C:46]([NH:47][CH:48]([C:49]([OH:50])=[O:51])[CH2:52][c:53]1[cH:54][cH:55][cH:56][cH:57][c:58]1[C:59]([F:60])([F:61])[F:62])=[O:63])([CH3:64])[CH3:65].[CH:66]([N:67]([CH2:68][CH3:69])[CH:70]([CH3:71])[CH3:72])([CH3:73])[CH3:74].[CH:75]([Cl:76])([Cl:77])[Cl:78].[Cl:1][c:2]1[cH:3][n:4][n:5]([CH3:17])[c:6]1-[c:7]1[cH:8][c:9]([C:14](=[O:15])[OH:16])[s:10][c:11]1[O:12][CH3:13].[NH2:18][CH:19]([CH2:20][N:21]1[C:22](=[O:31])[c:23]2[cH:24][cH:25][cH:26][cH:27][c:28]2[C:29]1=[O:30])[CH2:32][c:33]1[cH:34][c:35]([C:39]([F:40])([F:41])[F:42])[cH:36][cH:37][cH:38]1>>[Cl:1][c:2]1[cH:3][n:4][n:5]([CH3:17])[c:6]1-[c:7]1[cH:8][c:9]([C:14](=[O:16])[NH:18][CH:19]([CH2:20][N:21]2[C:22](=[O:31])[c:23]3[cH:24][cH:25][cH:26][cH:27][c:28]3[C:29]2=[O:30])[CH2:32][c:33]2[cH:34][c:35]([C:39]([F:40])([F:41])[F:42])[cH:36][cH:37][cH:38]2)[s:10][c:11]1[O:12][CH3:13]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 6212ChloroformHCID 81531DiisopropylethylamineHCID 44446362-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)phenyl]propanoic AcidHCID 578263844-(4-chloro-1-methyl-1H-pyrazol-5-yl)-5-(methyloxy)-2-thiophenecarboxylic AcidHCID 178510801HCID 178510801, 화합물

생성물 1

HCID 76576357
4-(4-chloro-1-methylpyrazol-5-yl)-N-[1-(1,3-dioxoisoindol-2-yl)-3-[3-(trifluoromethyl)phenyl]propan-2-yl]-5-methoxythiophene-2-carboxamide

출처 및 근거

ORD 기록
ord-ce497f4fc28d4412871d1a4088c0cd6a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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