6-chloro-N-(3-methylsulphonylaminobenzyl)nicotinamide → 6-(5-Cyclopropylcarbamoyl-2-methyl-phenyl)-N-(3-methylsulphonylaminobenzyl)-nicotinamide

반응식

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

참가 물질

반응물 2

HCID 219145456-chloro-N-(3-methylsulphonylaminobenzyl)nicotinamide

HCID 21914577N-cyclopropyl-4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

생성물 1

HCID 219145366-(5-Cyclopropylcarbamoyl-2-methyl-phenyl)-N-(3-methylsulphonylaminobenzyl)-nicotinamide

출처 및 근거

ORD 기록: ord-0fdad94ee40a442083e7e604e65d42bb
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…