1-Butanol → HCID 67365197, compound
Reaction equation
[C:1](=[O:2])([CH2:3][CH3:4])[N:5]1[CH2:6][CH:7]2[CH2:8][CH:9]([c:12]3[cH:13][cH:14][c:15]([NH:18][S:19](=[O:20])(=[O:21])[c:22]4[cH:23][cH:24][c:25]([O:28][C:29]([F:30])([F:31])[F:32])[cH:26][cH:27]4)[cH:16][cH:17]3)[CH:10]2[CH2:11]1.[CH2:34]([OH:35])[CH2:36][CH2:37][CH3:38].[ClH:33]>>[NH:5]1[CH2:6][CH:7]2[CH2:8][CH:9]([c:12]3[cH:13][cH:14][c:15]([NH:18][S:19](=[O:20])(=[O:21])[c:22]4[cH:23][cH:24][c:25]([O:28][C:29]([F:30])([F:31])[F:32])[cH:26][cH:27]4)[cH:16][cH:17]3)[CH:10]2[CH2:11]1Participants
4
Sources & evidence
- ORD record
- ord-6369946ddef34d4f8578ccbd3efa5e8e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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