Hydrochloric Acid → N-(tert-butoxycarbonyl)-N'-[(1-chloro-5-isoquinolyl)sulfonyl]-1,3-propylenediamine
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][CH2:10][NH2:11])=[O:12].[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[Cl:20][c:21]1[n:22][cH:23][cH:24][c:25]2[c:26]([S:31](=[O:32])(=[O:33])[Cl:34])[cH:27][cH:28][cH:29][c:30]12.[Cl:36][c:37]1[c:38]2[c:39]([c:40]([S:41]([Cl:42])(=[O:43])=[O:44])[cH:45][cH:46][cH:47]2)[cH:48][cH:49][n:50]1.[Cl:51][CH2:52][Cl:53].[ClH:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][CH2:10][NH:11][S:31]([c:26]1[c:25]2[cH:24][cH:23][n:22][c:21]([Cl:20])[c:30]2[cH:29][cH:28][cH:27]1)(=[O:32])=[O:33])=[O:12]Participants
6
Sources & evidence
- ORD record
- ord-0069dc8c1fa54cd7bac7850879100087
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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