Chloride → HCID 135816406, compound
Reaction equation
[CH3:25][N:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[CH3:32][O:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[Cl-:40].[Cl-:41].[Cl-:42].[Cl-:43].[NH2:1][c:2]1[c:3]([NH:4][c:5]2[c:6]([C:16]([O:17][CH2:18][CH3:19])=[O:20])[c:7]3[c:8]([s:9]2)[cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]3)[cH:21][cH:22][cH:23][cH:24]1.[Ti+4:44]>>[N:1]1=[C:16]([N:29]2[CH2:28][CH2:27][N:26]([CH3:25])[CH2:31][CH2:30]2)[c:6]2[c:5]([s:9][c:8]3[c:7]2[cH:13][cH:12][c:11]([O:14][CH3:15])[cH:10]3)[NH:4][c:3]2[c:2]1[cH:24][cH:23][cH:22][cH:21]2Participants
6
Sources & evidence
- ORD record
- ord-120b2c932cb442b882dfc14eeb464022
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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