Benzenemethanamine, 3-chloro- → HCID 178452083, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][c:15]2[n:16][cH:17][c:18]3[c:19]([n:20]2)[nH:21][n:22][c:23]3-[c:24]2[n:25][c:26]([S:30]([CH3:31])=[O:32])[n:27][cH:28][cH:29]2)[CH2:12][CH2:13]1.[Cl:33][c:34]1[cH:35][c:36]([CH2:37][NH2:38])[cH:39][cH:40][cH:41]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][c:15]2[n:16][cH:17][c:18]3[c:19]([n:20]2)[nH:21][n:22][c:23]3-[c:24]2[n:25][c:26]([NH:38][CH2:37][c:36]3[cH:35][c:34]([Cl:33])[cH:41][cH:40][cH:39]3)[n:27][cH:28][cH:29]2)[CH2:12][CH2:13]1Participants
3
Sources & evidence
- ORD record
- ord-12294dcfb1754a44a9bf2e3e2f382870
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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