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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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2-(2,5-Dichloro-pyrimidin-4-ylamino)-N,N-dimethyl-benzenesulfonamide → 2-{5-Chloro-2-[3-(2-hydroxy-2-methyl-propyl)-8-methoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-7-ylamino]-pyrimidin-4-ylamino}-N,N-dimethyl-benzenesulfonamide

HRID 2310298
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반응식

HRID 2310298 반응식
[Cl:20][c:21]1[n:22][cH:23][c:24]([Cl:40])[c:25]([NH:27][c:28]2[c:29]([S:34](=[O:35])(=[O:36])[N:37]([CH3:38])[CH3:39])[cH:30][cH:31][cH:32][cH:33]2)[n:26]1.[NH2:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][c:17]1[O:18][CH3:19])[CH2:6][CH2:7][N:8]([CH2:11][C:12]([CH3:13])([OH:14])[CH3:15])[CH2:9][CH2:10]2>>[NH:1]([c:2]1[cH:3][c:4]2[c:5]([cH:16][c:17]1[O:18][CH3:19])[CH2:6][CH2:7][N:8]([CH2:11][C:12]([CH3:13])([OH:14])[CH3:15])[CH2:9][CH2:10]2)[c:21]1[n:22][cH:23][c:24]([Cl:40])[c:25]([NH:27][c:28]2[c:29]([S:34](=[O:35])(=[O:36])[N:37]([CH3:38])[CH3:39])[cH:30][cH:31][cH:32][cH:33]2)[n:26]1
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참가 물질

3

반응물 2

HCID 467382872-(2,5-Dichloro-pyrimidin-4-ylamino)-N,N-dimethyl-benzenesulfonamideHCID 672639621-(7-Amino-8-methoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-propan-2-ol

생성물 1

HCID 668304522-{5-Chloro-2-[3-(2-hydroxy-2-methyl-propyl)-8-methoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-7-ylamino]-pyrimidin-4-ylamino}-N,N-dimethyl-benzenesulfonamide

출처 및 근거

ORD 기록
ord-d47d46fad1544317aef796f4bf359e6c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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