Bicarbonate Ion → HCID 59506925, compound
Reaction equation
[C:39](=[O:40])([O-:41])[OH:42].[CH3:44][N:45]([CH3:46])[C:47](=[O:48])[CH3:49].[CH:33]1([C:36](=[O:37])[Cl:38])[CH2:34][CH2:35]1.[NH2:1][c:2]1[s:3][c:4]2[n:5][c:6]([N:11]([c:12]3[cH:13][c:14]([NH:18][C:19]([c:20]4[cH:21][c:22]([C:26]([CH3:27])([CH3:28])[C:29]#[N:30])[cH:23][cH:24][cH:25]4)=[O:31])[cH:15][cH:16][cH:17]3)[CH3:32])[n:7][cH:8][c:9]2[n:10]1.[Na+:43]>>[NH:1]([c:2]1[s:3][c:4]2[n:5][c:6]([N:11]([c:12]3[cH:13][c:14]([NH:18][C:19]([c:20]4[cH:21][c:22]([C:26]([CH3:27])([CH3:28])[C:29]#[N:30])[cH:23][cH:24][cH:25]4)=[O:31])[cH:15][cH:16][cH:17]3)[CH3:32])[n:7][cH:8][c:9]2[n:10]1)[C:36]([CH:33]1[CH2:34][CH2:35]1)=[O:37]Participants
6
Sources & evidence
- ORD record
- ord-07d63333d03b4af59b1a79a17b1ef8c0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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