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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Water → (5-(4-(Bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)methyl methanesulfonate

HRID 700502
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HRID 700502 반응식
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[cH:17][c:18]([CH2:31][OH:32])[cH:19][n:20][c:21]3[NH:22][c:23]3[cH:24][n:25][c:26]([O:29][CH3:30])[cH:27][cH:28]3)[n:12][c:13]([CH3:15])[n:14]2)[CH2:33][c:34]2[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]2)[cH:42][cH:43]1.[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:51][S:52]([Cl:53])(=[O:54])=[O:55].[Cl:57][CH2:58][Cl:59].[OH2:56]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[cH:17][c:18]([CH2:31][O:32][S:52]([CH3:51])(=[O:54])=[O:55])[cH:19][n:20][c:21]3[NH:22][c:23]3[cH:24][n:25][c:26]([O:29][CH3:30])[cH:27][cH:28]3)[n:12][c:13]([CH3:15])[n:14]2)[CH2:33][c:34]2[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]2)[cH:42][cH:43]1
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참가 물질

6

반응물 5

HCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 59548440(5-(4-(Bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)methanol

생성물 1

HCID 59548272
(5-(4-(Bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)methyl methanesulfonate

출처 및 근거

ORD 기록
ord-a818c5b382a14b9e98255830253645b7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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