Dichloromethane → N-[4-(5-fluoro-4-indol-1-yl-pyrimidin-2-ylamino)-cyclohexyl]-methanesulfonamide

HRID 299976

반응식

HRID 299976 반응식
[CH3:39][N:40]1[CH2:41][CH2:42][CH2:43][C:44]1=[O:45].[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[Cl:1][c:2]1[n:3][cH:4][c:5]([F:17])[c:6](-[n:8]2[cH:9][cH:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]23)[n:7]1.[Cl:46][CH2:47][Cl:48].[NH2:18][CH:19]1[CH2:20][CH2:21][CH:22]([NH:25][S:26](=[O:27])(=[O:28])[CH3:29])[CH2:23][CH2:24]1>>[c:2]1([NH:18][CH:19]2[CH2:20][CH2:21][CH:22]([NH:25][S:26](=[O:27])(=[O:28])[CH3:29])[CH2:23][CH2:24]2)[n:3][cH:4][c:5]([F:17])[c:6](-[n:8]2[cH:9][cH:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]23)[n:7]1

참가 물질

6

반응물 5

HCID 6344DichloromethaneHCID 13387N-methyl-2-pyrrolidoneHCID 81531DiisopropylethylamineHCID 18348422N-(4-aminocyclohexyl)methanesulfonamideHCID 866208441-(2-chloro-5-fluoro-pyrimidin-4-yl)-1H-indole

생성물 1

HCID 59743430N-[4-(5-fluoro-4-indol-1-yl-pyrimidin-2-ylamino)-cyclohexyl]-methanesulfonamide

출처 및 근거

ORD 기록
ord-4f013f49a7ec49dc9ef85e35228977b5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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