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Methanol → HCID 57989800, 화합물

HRID 2154389
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HRID 2154389 반응식
[CH3:54][OH:55].[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[c:18]([F:35])[c:19]([NH:23][S:24](=[O:25])(=[O:26])[c:27]4[c:28]([F:34])[cH:29][cH:30][c:31]([F:33])[cH:32]4)[cH:20][cH:21][cH:22]3)[n:10][c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[s:12]2)[n:7]1.[Cl:56][CH2:57][Cl:58].[NH2:36][CH2:37][CH2:38][N:39]1[C:40](=[O:44])[CH2:41][CH2:42][CH2:43]1>>[c:2]1([NH:36][CH2:37][CH2:38][N:39]2[C:40](=[O:44])[CH2:41][CH2:42][CH2:43]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:17]3[c:18]([F:35])[c:19]([NH:23][S:24](=[O:25])(=[O:26])[c:27]4[c:28]([F:34])[cH:29][cH:30][c:31]([F:33])[cH:32]4)[cH:20][cH:21][cH:22]3)[n:10][c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[s:12]2)[n:7]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 887MethanolHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 906601-(2-Aminoethyl)pyrrolidin-2-oneHCID 44516823N-[3-[5-(2-chloro-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-thiazol-4-yl]-2-fluorophenyl]-2,5-difluorobenzenesulfonamide

생성물 1

HCID 57989800HCID 57989800, 화합물

출처 및 근거

ORD 기록
ord-367809a9418d4acd831b5301ea7f08ba
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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