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Dichloromethane → 2-(3-{6-[2-(2,4-Dichloro-phenyl)-ethylamino]-2-methoxy-pyrimidin-4-yl}-phenyl)-2-methyl-propionic acid 2-dimethylamino-ethyl ester

HRID 665404
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인쇄 미리보기

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HRID 665404 반응식
[CH3:56][N:57]([CH2:58][CH2:59][OH:60])[CH3:61].[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][NH:11][c:12]2[cH:13][c:14](-[c:20]3[cH:21][c:22]([C:26]([C:27](=[O:28])[OH:29])([CH3:30])[CH3:31])[cH:23][cH:24][cH:25]3)[n:15][c:16]([O:18][CH3:19])[n:17]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:62][CH2:63][Cl:64].[P-:32]([F:33])([F:34])([F:35])([F:36])([F:37])[F:38].[n:39]1([O:40][C:41]([N:42]([CH3:43])[CH3:44])=[N+:45]([CH3:46])[CH3:47])[c:48]2[cH:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1>>[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][NH:11][c:12]2[cH:13][c:14](-[c:20]3[cH:21][c:22]([C:26]([C:27]([O:28][CH2:59][CH2:58][N:57]([CH3:56])[CH3:61])=[O:29])([CH3:30])[CH3:31])[cH:23][cH:24][cH:25]3)[n:15][c:16]([O:18][CH3:19])[n:17]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1
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참가 물질

6

반응물 5

HCID 6344DichloromethaneHCID 79022-(Dimethylamino)ethanolHCID 9886HexafluorophosphateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 11669780Pgd2-IN-1

생성물 1

HCID 576360852-(3-{6-[2-(2,4-Dichloro-phenyl)-ethylamino]-2-methoxy-pyrimidin-4-yl}-phenyl)-2-methyl-propionic acid 2-dimethylamino-ethyl ester

출처 및 근거

ORD 기록
ord-c7cc01a7020a4fe7a9fe05f4307897e3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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