3-(2-Methoxyethyl)-2,3,4,5-tetrahydro-1h-3-benzazepin-7-amine → 2-{5-Chloro-2-[3-(2-methoxy-ethyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-ylamino]-pyrimidin-4-ylamino}-5-methoxy-N-methyl-benzamide

반응식

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

참가 물질

반응물 2

HCID 574160893-(2-Methoxyethyl)-2,3,4,5-tetrahydro-1h-3-benzazepin-7-amine

HCID 866338972-(2,5-Dichloro-pyrimidin-4-ylamino)-5-methoxy-N-methyl-benzamide

생성물 1

HCID 668302332-{5-Chloro-2-[3-(2-methoxy-ethyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-ylamino]-pyrimidin-4-ylamino}-5-methoxy-N-methyl-benzamide

출처 및 근거

ORD 기록: ord-b30d0d134ccb41c3be817bb85e728b42
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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