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Diisopropylethylamine → Methyl 2-(7-(benzo[b]thiophen-5-yl)-2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidin-6-yl)pentanoate

HRID 281182
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HRID 281182 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]2[c:8]([n:9][c:10]([CH3:22])[c:11]([CH:14]([C:15](=[O:16])[O:17][CH3:18])[CH2:19][CH2:20][CH3:21])[c:12]2[Cl:13])[cH:23]1.[CH:42]([N:43]([CH:44]([CH3:45])[CH3:46])[CH2:47][CH3:48])([CH3:49])[CH3:50].[s:24]1[cH:25][cH:26][c:27]2[c:28]1[cH:29][cH:30][c:31]([B:33]1[O:34][C:35]([CH3:36])([CH3:37])[C:38]([CH3:39])([CH3:40])[O:41]1)[cH:32]2>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]2[c:8]([n:9][c:10]([CH3:22])[c:11]([CH:14]([C:15](=[O:16])[O:17][CH3:18])[CH2:19][CH2:20][CH3:21])[c:12]2-[c:31]2[cH:30][cH:29][c:28]3[s:24][cH:25][cH:26][c:27]3[cH:32]2)[cH:23]1
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반응물 3

HCID 81531DiisopropylethylamineHCID 27954552-(1-Benzothiophen-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneHCID 86674712Methyl 2-(2-tert-butyl-7-chloro-5-methylpyrazolo[1,5-a]pyrimidin-6-yl)pentanoate

생성물 1

HCID 67259298Methyl 2-(7-(benzo[b]thiophen-5-yl)-2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidin-6-yl)pentanoate

출처 및 근거

ORD 기록
ord-5ff11586baa24210a4a2893fc81f5b62
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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