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Acetic Acid → 1-(5-{3-[(4-Cyclobutylpyrimidin-2-yl)amino]-5-methylphenyl}-1,3-thiazol-2-yl)cyclobutanol

HRID 1237674
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반응식

HRID 1237674 반응식
[CH3:30][C:31](=[O:32])[OH:33].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([CH:8]2[CH2:9][CH2:10][CH2:11]2)[n:7]1.[NH2:12][c:13]1[cH:14][c:15](-[c:20]2[cH:21][n:22][c:23]([C:25]3([OH:29])[CH2:26][CH2:27][CH2:28]3)[s:24]2)[cH:16][c:17]([CH3:19])[cH:18]1.[O:34]1[CH2:35][CH2:36][O:37][CH2:38][CH2:39]1>>[c:2]1([NH:12][c:13]2[cH:14][c:15](-[c:20]3[cH:21][n:22][c:23]([C:25]4([OH:29])[CH2:26][CH2:27][CH2:28]4)[s:24]3)[cH:16][c:17]([CH3:19])[cH:18]2)[n:3][cH:4][cH:5][c:6]([CH:8]2[CH2:9][CH2:10][CH2:11]2)[n:7]1
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5

반응물 4

HCID 176Acetic AcidHCID 312751,4-DioxaneHCID 497584742-Chloro-4-cyclobutylpyrimidineHCID 584563951-[5-(3-Amino-5-methylphenyl)-1,3-thiazol-2-yl]cyclobutanol

생성물 1

HCID 584560801-(5-{3-[(4-Cyclobutylpyrimidin-2-yl)amino]-5-methylphenyl}-1,3-thiazol-2-yl)cyclobutanol

출처 및 근거

ORD 기록
ord-7f0c49a69ed743f796abbcda345cb0a3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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