Hexane → N-(6-methylthioquinolin-5-yl)-2-hexylaminodecanamide
Reaction equation
[CH2:26]([CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[NH2:32].[CH3:1][S:2][c:3]1[c:4]([NH:13][C:14]([CH:15]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[Br:24])=[O:25])[c:5]2[cH:6][cH:7][cH:8][n:9][c:10]2[cH:11][cH:12]1.[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH3:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44]>>[CH3:1][S:2][c:3]1[c:4]([NH:13][C:14]([CH:15]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[NH:32][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])=[O:25])[c:5]2[cH:6][cH:7][cH:8][n:9][c:10]2[cH:11][cH:12]1Participants
5
Sources & evidence
- ORD record
- ord-503e94b485ea4a8e94244d822b1fb95d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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