3-amino-7,8-dihydro-6H-5-oxa-9-aza-benzocycloheptene-9-carboxylic acid isopropyl ester → 3-[5-Chloro-4-(2-fluoro-6-methylcarbamoyl-phenylamino)-pyrimidin-2-ylamino]-7,8-dihydro-6H-5-oxa-9-aza-benzocycloheptene-9-carboxylic acid isopropyl ester
반응식
[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH2:10][O:11][c:12]2[c:13]1[cH:14][cH:15][c:16]([NH2:18])[cH:17]2.[Cl:19][c:20]1[n:21][cH:22][c:23]([Cl:38])[c:24]([NH:26][c:27]2[c:28]([C:29](=[O:30])[NH:31][CH3:32])[cH:33][cH:34][cH:35][c:36]2[F:37])[n:25]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH2:10][O:11][c:12]2[c:13]1[cH:14][cH:15][c:16]([NH:18][c:20]1[n:21][cH:22][c:23]([Cl:38])[c:24]([NH:26][c:27]3[c:28]([C:29](=[O:30])[NH:31][CH3:32])[cH:33][cH:34][cH:35][c:36]3[F:37])[n:25]1)[cH:17]2참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-f03bdddca6d84469a1cd37b899628abc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)